Scientific name	Authority	First published in
Ligusticum foeniculum	Roth	Tent. Fl. Germ. 1: 124 (1788)
Meum foeniculum	Spreng.	Syst. Veg., ed. 15 bis 6: 483 (1820)
Meum piperitum	Schult.	Syst. Veg., ed. 15 bis 6: 435 (1820)
Ozodia foeniculacea	Wight & Arn.	Prodr. Fl. Ind. Orient. : 375 (1834)
Selinum foeniculum	E.H.L.Krause	Deutschl. Fl. Abbild. , ed. 2, 12: 115 (1904)
Seseli piperitum	Koso-Pol.	Bull. Soc. Imp. Naturalistes Moscou , n.s., 29: 183 (1915 publ. 1916)
Seseli dulce	Koso-Pol.	Bull. Soc. Imp. Naturalistes Moscou , n.s., 29: 183 (1915 publ. 1916)
Seseli foeniculum	Koso-Pol.	Bull. Soc. Imp. Naturalistes Moscou , n.s., 29: 183 (1915 publ. 1916)
Anethum dulce	DC.	Cat. Pl. Horti Monsp. : 78 (1813)
Anethum foeniculum	L.	Sp. Pl. : 263 (1753)
Anethum minus	Gouan	Ill. Observ. Bot. : 20 (1773)
Anethum panmori	Roxb.	Asiat. Res. 11: 156 (1810)
Anethum panmorium	Roxb.	Asiat. Res. 11: 156 (1810)
Anethum piperitum	Ucria	Arch. Bot. [Leipzig] 1(1): 68. 1796
Anethum rupestre	Salisb.	Prodr. Stirp. Chap. Allerton : 168 (1796)
Foeniculum azoricum	Mill.	Gard. Dict. ed. 8 : n.º 3 (1768)
Foeniculum capillaceum	Gilib.	Fl. Lit. Inch. ii. 40. 1782
Foeniculum divaricatum	Griseb.	Spic. Fl. Rumel. 1: 358 (1843)
Foeniculum dulce	Mill.	Gard. Dict. ed. 8 : n.º 2 (1768)
Foeniculum foeniculum	H.Karst.	Deut. Fl. (Karsten) 837. 1882 [Sep 1882]
Foeniculum giganteum	Lojac.	Fl. Sicul. 3: 445 (1909)
Foeniculum officinale	All.	Fl. Pedem. 2: 25 (1785)
Foeniculum panmorium	DC.	Prodr. 4: 142 (1830)
Foeniculum piperitum	C.Presl	Fl. Sicul. : xxvi (1826)
Foeniculum rigidum	Brot. ex Steud.	Nomencl. Bot. , ed. 2, 1: 643 (1840)
Foeniculum vulgare subsp. piperitum	(C.Presl) Bég.	Ann. Mus. Civico Storia Nat. "Giacomo Doria" III, 3: 447 1907
Foeniculum vulgare var. sativum	C.Presl	Fl. Sicul. xxvi 1826
Foeniculum vulgare subsp. sativum	Janch. ex Holub	Folia Geobot. Phytotax. 28(1): 106. 1993
Foeniculum vulgare var. capillaceum	Burnat	Fl. Alpes Marit. 4: 179 1906
Foeniculum vulgare var. dulce	(Mill.) Batt. & Trab.	Fl. Algérie Tunisie 147 1905
Foeniculum vulgare var. inodorum	Maire	Bull. Soc. Hist. Nat. Afrique N. 26: 205 1935
Foeniculum vulgare var. piperitum	(C.Presl) Ball	Spic. Moroc. 472 1878
Foeniculum vulgare subsp. capillaceum	(Burnat) Holmboe	Stud. Veg. Cypr. 140 1914
Ligusticum foeniculum	Crantz	Cl. Umbell. Emend. : 82 (1767)
Anethum pannorium	Roxb.

Common names Top

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Filter by language:

Language	Common/alternative name
English	sweet fennel
English	fennel
Spanish	hinojo
Spanish	foeniculum officinale
Spanish	anethum piperitum
Spanish	foeniculum piperitum
Spanish	anethum foeniculum
Spanish	foeniculum divaricatum
Spanish	foeniculum dulce
Spanish	acinojo
Spanish	anethum dulce
Spanish	anethum foeniculum var piperitum
Spanish	anethum foeniculum var. piperitum
Spanish	anis bravo
Spanish	anís bravo
Spanish	anis de florencia
Spanish	anís de florencia
Spanish	anisete silvestre
Spanish	arinojo
Spanish	caniguera
Spanish	cañiguera
Spanish	cenojo
Spanish	cenoyo
Spanish	cinoho
Spanish	cinojo
Spanish	cinoyo
Spanish	enoyo
Spanish	esmeldo
Spanish	fanoyo
Spanish	feniculo
Spanish	fenículo
Spanish	fenojo
Spanish	fenollo
Spanish	fenoyo
Spanish	fenullo
Spanish	finojo
Spanish	fiollo
Spanish	fioyo
Spanish	foeniculum azoricum
Spanish	foeniculum capillaceum
Spanish	foeniculum capillaceum f dulce
Spanish	foeniculum capillaceum f. dulce
Spanish	foeniculum capillaceum subsp piperitum
Spanish	foeniculum capillaceum subsp. piperitum
Spanish	foeniculum capillaceum var macrocarpum
Spanish	foeniculum capillaceum var. macrocarpum
Spanish	foeniculum officinale subsp dulce
Spanish	foeniculum officinale subsp pateri
Spanish	foeniculum officinale subsp. dulce
Spanish	foeniculum officinale subsp. pateri
Spanish	foeniculum officinale var dulce
Spanish	foeniculum officinale var sativum
Spanish	foeniculum officinale var. dulce
Spanish	foeniculum officinale var. sativum
Spanish	foeniculum piperitum subsp divaricatum
Spanish	foeniculum piperitum subsp. divaricatum
Spanish	foeniculum piperitum var pluriradiatum
Spanish	foeniculum piperitum var. pluriradiatum
Spanish	foeniculum sativum
Spanish	funcho
Spanish	funcho bravo
Spanish	funcho ordinario
Spanish	funcho silvestre
Spanish	hacinojo
Spanish	hinojo amargo
Spanish	hinojo comun
Spanish	hinojo común
Spanish	hinojo domestico
Spanish	hinojo doméstico
Spanish	hinojo hortense
Spanish	hinojo salvaje
Spanish	hinojo vulgar
Spanish	inojo
Spanish	jenoyo
Spanish	jinojo
Spanish	ligusticum foeniculum
Spanish	mellu
Spanish	meum foeniculum
Spanish	meum piperitum
Spanish	millua
Spanish	perejil de gitano
Spanish	tenojo
Spanish	tinojo
Spanish	zenojo
Spanish	zenoll
Spanish	zenollo
Spanish	zenullo
Spanish	zinojo
Afrikaans	vinkel
Arabic	شمر
Arabic	الشمر
Arabic	شومر
Arabic	شمرة شائعة
Arabic	البسباس
Arabic	شبث
Arabic	الشمر البري
Arabic	شمار
Arabic	شمرة عذبة
Arabic	رازيانج
Arabic	سذاب البر
Arabic	فينوكيا
Assamese	চফ
Azerbaijani	adi razyana
azb	رازیانه
ba	Фенхель үләне
ban	adas
Belarusian	фенхель звычайны
Bulgarian	резене
Bengali	গুড়ামুসুরী
Bengali	পান মুহুরী
Bengali	মিঠা জিরা
Bengali	মৌরী
Bengali	মৌরি
br	fanouilh
br	lost-louarn
Bosnian	komorač
Catalan	fonoll
Catalan	fenoll
ce	Йиппар
co	finochju
Czech	fenykl obecný
Czech	fenykl
Welsh	ffenigl
Danish	almindelig fennikel
German	echter fenchel
German	fenchelkraut
German	fencheltee
German	gemüsefenchel
German	fenchel
dv	ދަވިއްގަނދު
Greek	Μάραθος
Greek	Μάραθρο
Greek	Φοινίκουλον
Greek	Μάραθο
Esperanto	ordinara fenkolo
Estonian	harilik apteegitill
Basque	mihilu
Persian	رازیانه
Finnish	maustefenkoli
Finnish	italiankumina
Finnish	saksankumina
Finnish	salaattifenkoli
Finnish	salaattivenkoli
Finnish	fenkoli
French	fenouil commun
French	fenouil sauvage
frr	fenchel
Irish	finéal
Galician	hinoxo
Galician	fiúncho
gom	बडिशेप
gor	denggu-denggu
Gujarati	વરિયાળી
Hebrew	שומר פשוט
Hindi	सौंफ़
Hindi	सौंफ
hil	inóho
Croatian	komorač
Upper Sorbian	bjenchl
Upper Sorbian	koprica
ht	anis
Hungarian	foeniculi fructus
Hungarian	kerti édeskömény
Hungarian	édeskömény
Armenian	Հոռոմ-սամիթ սովորական
Indonesian	adas pedas
Indonesian	pohon adas
Indonesian	adas
io	fenikulo
Icelandic	fennikka
Italian	foeniculum officinale
Italian	finocchi
Italian	finocchietto
Italian	finocchio selvatico
Italian	finocchio
Japanese	フェンネル
Japanese	茴香
Japanese	ういきょう
Japanese	フヌイユ
Japanese	小茴香
Japanese	ウイキョウ
jv	adas
Georgian	დიდი კამა
Kabyle	tansawt
Kazakh	Волош аскөгі
Kannada	ಸೊಂಪು
Korean	회향
ku	cehcehik
ku	rizyane
Cornish	fenoghel
lb	fenchel
lij	fenoggio
lmo	fenòcc
lmo	fenoeugg
Lithuanian	pankolis
Lithuanian	paprastasis pankolis
Latvian	parastais fenhelis
mad	aḍḍhâs
mai	सुप
min	adeh
Macedonian	коморач
Macedonian	морач
Malayalam	fennel
Malayalam	സ്ഥൂലജീരകം
Malayalam	പെരുംജീരകം
Marathi	बडीसोप
Marathi	बडीशेप
Malay	pokok adas
mt	busbies
mt	bużbież
Burmese	စမုန်စပါး
nap	fënuocchië salvátëchë
Norwegian Bokmål	fenikkel
Norwegian Bokmål	fennikel
Nepali	सुप
Dutch	venkel
Dutch	knolvenkel
Norwegian Nynorsk	fennikel
oc	fenolh
oc	fenon
oc	henolh
oc	holh
Oriya	ପାନମଧୁରୀ
os	Агъунцъагæ
Punjabi	ਮੇਥੀ
Polish	anethum foeniculum
Polish	fenkuł
Polish	koper włoski
Polish	fenkuł włoski
Punjab	سونف
Punjab	میتھی
Portuguese	anis-doce
Portuguese	erva doce
Portuguese	erva docê
Portuguese	funcho
Quechua	inuhu
Romanian	molură
Romanian	fenicul
Russian	укроп аптечный
Russian	укроп волошский
Russian	фенхель обыкновенный
sc	fenuju areste
sc	fenugu
sco	finkle
sd	وڏڦ
Serbo-Croatian	komorač
Sinhala	මාදුරු
Slovak	fenikel obyčajný
Slovenian	komarček
Slovenian	navadni komarček
Albanian	finoku
Albanian	maraja
Serbian	Коморач
su	adas
Swedish	fänkol
Swedish	fänkål
szy	nipaluma-yamsu, yamso
Tamil	சோம்பு
Tamil	பெருஞ்சீரகம்
Telugu	సోంపు
tg	Бодиён, зираи сафед
Thai	ผักชีล้อม
Thai	ยี่หร่าฝรั่ง
Turkish	rezene
Ukrainian	фенхель
Ukrainian	фенхель звичайний
Urdu	fennel
Urdu	سونف
Chinese	孜然芹
Chinese	小茴香
Chinese	小茴香根皮
Chinese	茴香
Chinese	茴香（小茴香）
Chinese	茴香子
Chinese	茴香根
Chinese	茴香茎叶

Subspecies (abbr. subsp./ssp.) Top

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No subspecies added yet.

Varieties (abbr. var.) Top

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No variety added yet.

Subvarieties (abbr. subvar.) Top

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No subvariety added yet.

Forms (abbr. f.) Top

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No forms added yet.

Germination/Propagation Top

Suggest a correction or add new data!

Sow seeds at 20°C, expecting germination within 3 months without further temperature treatment.

Distribution (via POWO/KEW) Top

No distribution data was extracted from POWO/KEW yet. We are constantly monitoring for new data.

Links to other databases Top

Suggest others/fix!

Database	ID/link to page
World Flora Online	wfo-0000691487
UNII	J1UK54JBGH
Florida Plant Atlas	1767
Canadensys	2579
USDA Plants	FOVU
Tropicos	1700130
INPN	98756
KEW	urn:lsid:ipni.org:names:842680-1
The Plant List	kew-2813604
Missouri Botanical Garden	275990
PFAF	Foeniculum vulgare
Open Tree Of Life	498475
Observations.org	6793
NCBI Taxonomy	48038
NBN Atlas	NHMSYS0000458868
Nature Serve	2.159195
IPNI	136027-1
iNaturalist	53052
GBIF	3034922
Freebase	/m/017dqv
WisFlora	8249
EPPO	FOEVU
EOL	585008
Elurikkus	4781
Calflora (Californian flora)	3603
US Library of Congress	sh85047800
USDA GRIN	300219
Wikipedia	Fennel
CMAUP	NPO28295

Genomes (via NCBI) Top

Below is displayed the reference genome only!
If you wish to browse all genomes for this plant click here.

Accession	Assembly
Accession	Name	Level	Submitter	Released	Coverage	Size
GCA_003724115.2	FoenVul1.1	Scaffold	University of Padua	2018-11-13	N/A	0.94 Gb

Scientific Literature Top

Below are displayed the latest 15 articles published in PMC (PubMed Central®) and other sources (DOI number only)!
If you wish to see all the related articles click here.

Title

Authors

Publication

Released

IDs

Contribution for the Characterization of Portuguese Fennel Chemotypes

Carlos M.F. Cavaleiro, Odete L. Roque, António Proença da Cunha

Informa UK Limited

30-Aug-2018

doi:	10.1080/10412905.1993.9698207

Cytotoxicity of the Essential Oil of Fennel (Foeniculum vulgare) from Tajikistan.

Sharopov F, Valiev A, Satyal P, Gulmurodov I, Yusufi S, Setzer WN, Wink M

Foods

28-Aug-2017

PMCID:	PMC5615285
doi:	10.3390/FOODS6090073
PMID:	28846628

Fenicularin, a Quercetin 3-Arabinoside from the Leaves of Foeniculum vulgare MILL

Tatsuo Ohta, Toshio Miyazaki

Pharmaceutical Society of Japan

20-Apr-2017

doi:	10.1248/YAKUSHI1947.79.7_986

Investigation of the cytotoxic, genotoxic, and apoptosis-inducing effects of estragole isolated from fennel (Foeniculum vulgare).

Villarini M, Pagiotti R, Dominici L, Fatigoni C, Vannini S, Levorato S, Moretti M

J Nat Prod

25-Apr-2014

doi:	10.1021/NP400653P
PMID:	24617303

Antimycobacterial activity of constituents from Foeniculum vulgare var. dulce grown in Mexico.

Esquivel-Ferriño PC, Favela-Hernández JM, Garza-González E, Waksman N, Ríos MY, del Rayo Camacho-Corona M

Molecules

13-Jul-2012

PMCID:	PMC6268697
doi:	10.3390/MOLECULES17078471
PMID:	22797778

The Influence of Distillation Conditions on the Essential Oil Composition of Three Varieties ofFoeniculum vulgareMill.

Mauro Marotti, Roberta Piccaglia

Informa UK Limited

24-Apr-2012

doi:	10.1080/10412905.1992.9698137

Essential Oil ofFoeniculum vulgareMill. (Fennel) subsp.piperitum(Ucria) Cout. Fruit

Alain Badoc, Gérard Deffieux, Ahmed Lamarti, Guy Bourgeois, Jean-Pierre Carde

Informa UK Limited

24-Apr-2012

doi:	10.1080/10412905.1994.9698394

CHEMICAL CONSTITUENTS FROM ALGERIAN FOENICULUM VULGARE AERIAL PARTS AND EVALUATION OF ANTIMICROBIAL ACTIVITY

AMAR ZELLAGUI, NOUREDDINE GHERRAF, AHMED ELKHATEEB, MOHAMED-ELAMIR F HEGAZY, TARIK A MOHAMED, AHMED TOUIL, ABDELAATY A SHAHAT, SALAH RHOUATI

SciELO Agencia Nacional de Investigacion y Desarrollo (ANID)

23-Jan-2012

doi:	10.4067/S0717-97072011000300008

Water-Soluble Constituents of Fennel. IX. Glucides and Nucleosides.

Junichi KITAJIMA, Toru ISHIKAWA, Tasuko TANAKA, Yoshiteru IDA

Pharmaceutical Society of Japan

08-Dec-2011

doi:	10.1248/CPB.47.988

Constituents of Fennel. X. New Chromanone and Phenylethanoid Glycosides, and threo-Epoxyanethole.

Junichi KITAJIMA, Toru ISHIKAWA, Yasuko TANAKA, Yoshiteru IDA

Pharmaceutical Society of Japan

08-Dec-2011

doi:	10.1248/CPB.47.1448

Water-Soluble Constituents of Fennel. V. Glycosides of Aromatic Compounds.

Junichi KITAJIMA, Toru ISHIKAWA, Yasuko TANAKA, Masateru ONO, Yasuyuki ITO, Toshihiro NOHARA

Pharmaceutical Society of Japan

08-Dec-2011

doi:	10.1248/CPB.46.1587

Water-Soluble Constituents of Fennel. I. Alkyl Glycosides.

Junichi KITAJIMA, Toru ISHIKAWA, Yasuko TANAKA

Pharmaceutical Society of Japan

08-Dec-2011

doi:	10.1248/CPB.46.1643

Water-Soluble Constituents of Fennel. VII. Acyclic Monoterpenoid Glycosides.

Toru ISHIKAWA, Yasuko TANAKA, Junichi KITAJIMA

Pharmaceutical Society of Japan

08-Dec-2011

doi:	10.1248/CPB.46.1748

Water-Soluble Constituents of Fennel. VI. 1,8-Cineole Type Glycosides.

Toru ISHIKAWA, Junichi KITAJIMA, Yasuko TANAKA, Masateru ONO, Yasuyuki ITO, Toshihiro NOHARA

Pharmaceutical Society of Japan

08-Dec-2011

doi:	10.1248/CPB.46.1738

Five New Monoterpene Glycosides and Other Compounds from Foeniculi Fructus (Fruit of Foeniculum vulgare MILLER).

Masateru ONO, Yasuyuki ITO, Thoru ISHIKAWA, Junichi KITAJIMA, Yasuko TANAKA, Yujiro NIIHO, Toshihiro NOHARA

Pharmaceutical Society of Japan

08-Dec-2011

doi:	10.1248/CPB.44.337

Phytochemical Profile Top

Add a new one!

Below are displayed the proven (via scientific papers) natural compounds!
You can also contribute to this by clicking here.

Name	PubChem ID	Canonical SMILES	MW	Found in	Proof
> Acetylides
Propargyl alcohol	7859	Click to see C#CCO	56.06	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives
1,2,4,5-Tetramethylbenzene	7269	Click to see CC1=CC(=C(C=C1C)C)C	134.22	unknown	via CMAUP database
Benzaldehyde, oxime, (Z)-	5324470	Click to see C1=CC=C(C=C1)C=NO	121.14	unknown	via CMAUP database
Diphenylcyclopropenone	65057	Click to see C1=CC=C(C=C1)C2=C(C2=O)C3=CC=CC=C3	206.24	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acid esters
Butyl isobutyl phthalate	28813	Click to see CCCCOC(=O)C1=CC=CC=C1C(=O)OCC(C)C	278.34	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives
2,5-Dihydroxybenzoic acid	3469	Click to see C1=CC(=C(C=C1O)C(=O)O)O	154.12	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives
Syringic acid	10742	Click to see COC1=CC(=CC(=C1O)OC)C(=O)O	198.17	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / M-methoxybenzoic acids and derivatives
Vanillic Acid	8468	Click to see COC1=C(C=CC(=C1)C(=O)O)O	168.15	unknown	https://doi.org/10.1021/JF0713253
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / P-methoxybenzoic acids and derivatives
3,4-Dimethoxybenzoic acid	7121	Click to see COC1=C(C=C(C=C1)C(=O)O)OC	182.17	unknown	https://doi.org/10.1021/JF0713253
4-Methoxybenzoate	3783514	Click to see COC1=CC=C(C=C1)C(=O)[O-]	151.14	unknown	via CMAUP database
Methyl 4-methoxybenzoate	8499	Click to see COC1=CC=C(C=C1)C(=O)OC	166.17	unknown	https://doi.org/10.1021/JF0713253
p-Anisic acid	7478	Click to see COC1=CC=C(C=C1)C(=O)O	152.15	unknown	https://doi.org/10.1021/JF0713253 https://doi.org/10.1079/9781845934057.0227 https://doi.org/10.1248/CPB.47.1448
> Benzenoids / Benzene and substituted derivatives / Benzoyl derivatives
Benzaldehyde	240	Click to see C1=CC=C(C=C1)C=O	106.12	unknown	via CMAUP database
p-Anisaldehyde	31244	Click to see COC1=CC=C(C=C1)C=O	136.15	unknown	https://doi.org/10.1080/10412905.1992.9698137 https://doi.org/10.1211/0022357991777218 https://doi.org/10.1021/JF0713253 https://doi.org/10.1079/9781845934057.0227 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5615285/ https://doi.org/10.1021/JF000171N https://doi.org/10.1007/BF02860485
p-Anisaldehyde-\|A-d1	11252044	Click to see COC1=CC=C(C=C1)C=O	137.15	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzyl alcohols
4-Methoxybenzyl alcohol	7738	Click to see COC1=CC=C(C=C1)CO	138.16	unknown	https://doi.org/10.1089/JMF.2008.0327 https://doi.org/10.1211/0022357991777218
> Benzenoids / Benzene and substituted derivatives / Cumenes
m-Cymene	10812	Click to see CC1=CC(=CC=C1)C(C)C	134.22	unknown	https://doi.org/10.1016/J.JPBA.2006.01.024
o-Cymene	10703	Click to see CC1=CC=CC=C1C(C)C	134.22	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Methoxybenzenes / Dimethoxybenzenes
1,4-Dimethoxybenzene	9016	Click to see COC1=CC=C(C=C1)OC	138.16	unknown	via CMAUP database
Isoeugenyl methyl ether	1549045	Click to see CC=CC1=CC(=C(C=C1)OC)OC	178.23	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Phenylpropanes
(1R,2S)-1-(4-Methoxyphenyl)-1,2-propanediol	9799166	Click to see CC(C(C1=CC=C(C=C1)OC)O)O	182.22	unknown	https://doi.org/10.1248/CPB.47.1448
(1S,2S)-1-(4-methoxyphenyl)propane-1,2-diol	12387012	Click to see CC(C(C1=CC=C(C=C1)OC)O)O	182.22	unknown	https://doi.org/10.1021/JF0713253
1-(4-Methoxyphenyl)propane-1,2-diol	3016654	Click to see CC(C(C1=CC=C(C=C1)OC)O)O	182.22	unknown	https://doi.org/10.1248/CPB.47.1448 https://doi.org/10.1021/JF0713253
2-Methoxyphenylacetone	78887	Click to see CC(=O)CC1=CC=CC=C1OC	164.20	unknown	https://doi.org/10.1016/J.JPBA.2006.01.024
4-Methoxyphenylacetone	31231	Click to see CC(=O)CC1=CC=C(C=C1)OC	164.20	unknown	via CMAUP database
Cathine	441457	Click to see CC(C(C1=CC=CC=C1)O)N	151.21	unknown	https://doi.org/10.1016/J.JPBA.2006.01.024
> Benzenoids / Benzene and substituted derivatives / Styrenes
Styrene	7501	Click to see C=CC1=CC=CC=C1	104.15	unknown	via CMAUP database
trans-beta-Methylstyrene	252325	Click to see CC=CC1=CC=CC=C1	118.18	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Xylenes / m-Xylenes
2,4-Dimethylaniline	7250	Click to see CC1=CC(=C(C=C1)N)C	121.18	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Xylenes / o-Xylenes
4-Ethyl-1,2-dimethylbenzene	13629	Click to see CCC1=CC(=C(C=C1)C)C	134.22	unknown	via CMAUP database
> Benzenoids / Naphthalenes / Naphthoquinones
Juglone	3806	Click to see C1=CC2=C(C(=O)C=CC2=O)C(=C1)O	174.15	unknown	via CMAUP database
> Benzenoids / Phenol esters
(2-Methoxy-4-prop-1-enylphenyl) acetate	7137	Click to see CC=CC1=CC(=C(C=C1)OC(=O)C)OC	206.24	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6268697/
Isoeugenyl acetate	876160	Click to see CC=CC1=CC(=C(C=C1)OC(=O)C)OC	206.24	unknown	via CMAUP database
Phenol, 2-methoxy-4-(1-propenyl)-, acetate, (Z)-	1715136	Click to see CC=CC1=CC(=C(C=C1)OC(=O)C)OC	206.24	unknown	via CMAUP database
> Benzenoids / Phenol ethers
Mephenesin	4059	Click to see CC1=CC=CC=C1OCC(CO)O	182.22	unknown	https://doi.org/10.1016/J.JPBA.2006.01.024
> Benzenoids / Phenol ethers / Anisoles
4-(4-Methoxyphenyl)-2-butanone	61007	Click to see CC(=O)CCC1=CC=C(C=C1)OC	178.23	unknown	via CMAUP database
4-Methoxybenzaldehyde oxime	5371961	Click to see COC1=CC=C(C=C1)C=NO	151.16	unknown	via CMAUP database
Anethole	637563	Click to see CC=CC1=CC=C(C=C1)OC	148.20	unknown	https://doi.org/10.1016/S0168-9452(02)00279-0 https://doi.org/10.1016/S0305-1978(96)00106-8 https://doi.org/10.1055/S-2006-962632 https://doi.org/10.1055/S-2006-962631 https://doi.org/10.1002/PS.274 https://doi.org/10.1094/PHYTO.2000.90.7.710 https://doi.org/10.1080/10412905.1994.9698394 https://doi.org/10.1211/0022357991777218 https://doi.org/10.1021/JF0713253 https://doi.org/10.1080/10412905.1993.9698207 https://doi.org/10.1080/10412905.1992.9698137 https://doi.org/10.1079/9781845934057.0227 https://doi.org/10.1021/JF000171N
Anethole, (Z)-	1549040	Click to see CC=CC1=CC=C(C=C1)OC	148.20	unknown	https://doi.org/10.1089/JMF.2008.0327 https://doi.org/10.1080/10412905.1992.9698137
Anisole	7519	Click to see COC1=CC=CC=C1	108.14	unknown	via CMAUP database
Elemicin	10248	Click to see COC1=CC(=CC(=C1OC)OC)CC=C	208.25	unknown	via CMAUP database
Estragole	8815	Click to see COC1=CC=C(C=C1)CC=C	148.20	unknown	https://doi.org/10.1016/S0168-9452(02)00279-0 https://doi.org/10.1016/S0305-1978(96)00106-8 https://doi.org/10.1016/J.ARABJC.2010.11.006 https://doi.org/10.1055/S-2006-962632 https://doi.org/10.1055/S-2006-962631 https://doi.org/10.1002/PS.274 https://doi.org/10.1211/0022357991777218 https://doi.org/10.1021/NP400653P https://doi.org/10.1080/10412905.1993.9698207 https://doi.org/10.1080/10412905.1992.9698137 https://doi.org/10.1079/9781845934057.0227 https://doi.org/10.1055/S-2000-9773
Methoxy-4-propenylbenzene	7703	Click to see CC=CC1=CC=C(C=C1)OC	148.20	unknown	https://doi.org/10.1016/S0168-9452(02)00279-0 https://doi.org/10.1002/PS.274 https://doi.org/10.1211/0022357991777218 https://doi.org/10.1021/JF0713253 https://doi.org/10.1055/S-2006-962632 https://doi.org/10.1016/J.JPBA.2006.01.024 https://doi.org/10.1055/S-2006-962631 https://doi.org/10.1021/JF000171N
> Benzenoids / Phenols / Benzenediols / Resorcinols
Resorcinol	5054	Click to see C1=CC(=CC(=C1)O)O	110.11	unknown	via CMAUP database
> Benzenoids / Phenols / Methoxyphenols
(1R)-1-(3-Hydroxy-4-methoxyphenyl)-1,2-ethanediol	10631337	Click to see COC1=C(C=C(C=C1)C(CO)O)O	184.19	unknown	https://doi.org/10.1248/CPB.44.337
1-(3-Hydroxy-4-methoxyphenyl)ethane-1,2-diol	170451	Click to see COC1=C(C=C(C=C1)C(CO)O)O	184.19	unknown	https://doi.org/10.1248/CPB.44.337
Eugenol	3314	Click to see COC1=C(C=CC(=C1)CC=C)O	164.20	unknown	via CMAUP database
> Hydrocarbons / Polycyclic hydrocarbons
4-Methylbicyclo[3.1.0]hex-2-ene	144895707	Click to see CC1C=CC2C1C2	94.15	unknown	https://doi.org/10.1016/J.JPBA.2006.01.024
> Hydrocarbons / Saturated hydrocarbons / Alkanes
Docosane	12405	Click to see CCCCCCCCCCCCCCCCCCCCCC	310.60	unknown	via CMAUP database
Heneicosane	12403	Click to see CCCCCCCCCCCCCCCCCCCCC	296.60	unknown	via CMAUP database
Pentane	8003	Click to see CCCCC	72.15	unknown	via CMAUP database
Tricosane	12534	Click to see CCCCCCCCCCCCCCCCCCCCCCC	324.60	unknown	via CMAUP database
> Hydrocarbons / Saturated hydrocarbons / Cycloalkanes
Cyclopropane	6351	Click to see C1CC1	42.08	unknown	via CMAUP database
> Hydrocarbons / Unsaturated hydrocarbons / Branched unsaturated hydrocarbons
6-Methylenebicyclo[3.1.0]hexane	556304	Click to see C=C1C2C1CCC2	94.15	unknown	https://doi.org/10.1016/J.JPBA.2006.01.024
8(12)-Drimene	12184338	Click to see CC1C(=C)CCC2C1(CCCC2(C)C)C	206.37	unknown	via CMAUP database
gamma-Terpinene	7461	Click to see CC1=CCC(=CC1)C(C)C	136.23	unknown	https://doi.org/10.1080/10412905.1994.9698394 https://doi.org/10.1080/10412905.1993.9698207 https://doi.org/10.1080/10412905.1992.9698137
> Hydrocarbons / Unsaturated hydrocarbons / Unsaturated aliphatic hydrocarbons
2-Heptene	11611	Click to see CCCCC=CC	98.19	unknown	https://doi.org/10.1016/J.JPBA.2006.01.024
cis-2-Heptene	643836	Click to see CCCCC=CC	98.19	unknown	via CMAUP database
trans-2-Heptene	639662	Click to see CCCCC=CC	98.19	unknown	via CMAUP database
> Lipids and lipid-like molecules / Endocannabinoids
1,3-Dihydroxypropan-2-yl 3,8-diacetyloxyicosanoate	163021367	Click to see CCCCCCCCCCCCC(CCCCC(CC(=O)OC(CO)CO)OC(=O)C)OC(=O)C	502.70	unknown	https://doi.org/10.1248/CPB.46.1643
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters / Fatty acid methyl esters
Methyl butyrate	12180	Click to see CCCC(=O)OC	102.13	unknown	https://doi.org/10.1021/JF050340+
Methyl isovalerate	11160	Click to see CC(C)CC(=O)OC	116.16	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6268697/
Methyl palmitate	8181	Click to see CCCCCCCCCCCCCCCC(=O)OC	270.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Branched fatty acids / Methyl-branched fatty acids
2-Isopropylpentanoic acid	147513	Click to see CCCC(C(C)C)C(=O)O	144.21	unknown	https://doi.org/10.1016/J.JPBA.2006.01.024
2-Methylbutanoic acid	8314	Click to see CCC(C)C(=O)O	102.13	unknown	https://doi.org/10.1021/JF050340+
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids
(Z)-9,10-dideuteriooctadec-9-enoic acid	13011408	Click to see CCCCCCCCC=CCCCCCCCC(=O)O	284.50	unknown	via CMAUP database
9-Octadecenoic acid	965	Click to see CCCCCCCCC=CCCCCCCCC(=O)O	282.50	unknown	https://doi.org/10.1021/JF020504B
Elaidic Acid	637517	Click to see CCCCCCCCC=CCCCCCCCC(=O)O	282.50	unknown	https://doi.org/10.1021/JF020504B
Oleic Acid	445639	Click to see CCCCCCCCC=CCCCCCCCC(=O)O	282.50	unknown	https://doi.org/10.1007/BF02660162 https://doi.org/10.1079/9781845934057.0227
Palmitic Acid	985	Click to see CCCCCCCCCCCCCCCC(=O)O	256.42	unknown	https://doi.org/10.1007/BF02660162
Petroselinic acid	5281125	Click to see CCCCCCCCCCCC=CCCCCC(=O)O	282.50	unknown	https://doi.org/10.1079/9781845934057.0227 https://doi.org/10.1007/BF02660162
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Medium-chain fatty acids
Sorbic Acid	643460	Click to see CC=CC=CC(=O)O	112.13	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6268697/
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acyl glycosides / Fatty acyl glycosides of mono- and disaccharides
(2S,3R,4S,5S,6R)-2-[(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoxy]-6-(hydroxymethyl)oxane-3,4,5-triol	163185759	Click to see COC1=CC(=CC(=C1O)OC)C=CCOC2C(C(C(C(O2)CO)O)O)O	372.40	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2007.03.029
(2S,3R,4S,5S,6R)-2-[3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoxy]-6-(hydroxymethyl)oxane-3,4,5-triol	162885540	Click to see COC1=CC(=CC(=C1O)OC)C=CCOC2C(C(C(C(O2)CO)O)O)O	372.40	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2007.03.029
2-(6-Hydroxy-2,6-dimethylocta-2,7-dienoxy)-6-(hydroxymethyl)oxane-3,4,5-triol	72970728	Click to see CC(=CCCC(C)(C=C)O)COC1C(C(C(C(O1)CO)O)O)O	332.39	unknown	https://doi.org/10.1248/CPB.46.1748
Betulalbuside A	10382095	Click to see CC(=CCCC(C)(C=C)O)COC1C(C(C(C(O1)CO)O)O)O	332.39	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohol esters
9-Acetoxynonanal	537145	Click to see CC(=O)OCCCCCCCCC=O	200.27	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6268697/
Geranyl butyrate	5355856	Click to see CCCC(=O)OCC=C(C)CCC=C(C)C	224.34	unknown	https://doi.org/10.1055/S-2000-9773
tris[(8Z,11Z)-heptadeca-8,11-dienyl] propane-1,2,3-tricarboxylate	45109763	Click to see CCCCCC=CCC=CCCCCCCCOC(=O)CC(CC(=O)OCCCCCCCC=CCC=CCCCCC)C(=O)OCCCCCCCC=CCC=CCCCCC	879.40	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols
(3R)-oct-1-en-3-ol	6992244	Click to see CCCCCC(C=C)O	128.21	unknown	via CMAUP database
(R)-(-)-2-Heptanol	6992611	Click to see CCCCCC(C)O	116.20	unknown	via CMAUP database
(S)-(+)-2-Heptanol	2724897	Click to see CCCCCC(C)O	116.20	unknown	via CMAUP database
(S)-1-Octen-3-ol	2724898	Click to see CCCCCC(C=C)O	128.21	unknown	via CMAUP database
1-Octanol	957	Click to see CCCCCCCCO	130.23	unknown	via CMAUP database
1-Octen-3-OL	18827	Click to see CCCCCC(C=C)O	128.21	unknown	via CMAUP database
1-Undecanol	8184	Click to see CCCCCCCCCCCO	172.31	unknown	via CMAUP database
2-Heptanol	10976	Click to see CCCCCC(C)O	116.20	unknown	via CMAUP database
5-Methyl-2-heptanol	41143	Click to see CCC(C)CCC(C)O	130.23	unknown	https://doi.org/10.1016/J.JPBA.2006.01.024
Citronellol epoxide	98467	Click to see CC(CCC1C(O1)(C)C)CCO	172.26	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6268697/
Hexane-1,6-diol	12374	Click to see C(CCCO)CCO	118.17	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols / Long-chain fatty alcohols
(3S,9E)-heptadeca-1,9-dien-4,6-diyn-3-ol	71308196	Click to see CCCCCCCC=CCC#CC#CC(C=C)O	244.37	unknown	via CMAUP database
(E,R)-Heptadeca-1,9-dien-4,6-diyne-3-ol	56935896	Click to see CCCCCCCC=CCC#CC#CC(C=C)O	244.37	unknown	via CMAUP database
1-Tridecanol	8207	Click to see CCCCCCCCCCCCCO	200.36	unknown	via CMAUP database
cis-(-)-Heptadeca-1,9-dien-4,6-diyn-3-ol	5353620	Click to see CCCCCCCC=CCC#CC#CC(C=C)O	244.37	unknown	via CMAUP database
Falcarinol	5281149	Click to see CCCCCCCC=CCC#CC#CC(C=C)O	244.37	unknown	via CMAUP database
Heptadeca-1,9-dien-4,6-diyn-3-ol	3322	Click to see CCCCCCCC=CCC#CC#CC(C=C)O	244.37	unknown	via CMAUP database
Panaxynol	5469789	Click to see CCCCCCCC=CCC#CC#CC(C=C)O	244.37	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty aldehydes
Pentadeca-2,14-dienal	71348716	Click to see C=CCCCCCCCCCCC=CC=O	222.37	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Lineolic acids and derivatives
9,12-Octadecadienoate	5867807	Click to see CCCCCC=CCC=CCCCCCCCC(=O)[O-]	279.40	unknown	via CMAUP database
Linoleic Acid	5280450	Click to see CCCCCC=CCC=CCCCCCCCC(=O)O	280.40	unknown	https://doi.org/10.1007/BF02660162 https://doi.org/10.1079/9781845934057.0227
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Acyclic diterpenoids
Isophytol	10453	Click to see CC(C)CCCC(C)CCCC(C)CCCC(C)(C=C)O	296.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Taxanes and derivatives
[(1R,2R,3Z,5S,7S,8E,10R,13S)-7,9,10,13-tetraacetyloxy-2,5-dihydroxy-8,12,15,15-tetramethyl-4-bicyclo[9.3.1]pentadeca-3,8,11-trienyl]methyl acetate	100927232	Click to see CC1=C2C(C(=C(C(CC(C(=CC(C(C2(C)C)CC1OC(=O)C)O)COC(=O)C)O)OC(=O)C)C)OC(=O)C)OC(=O)C	594.60	unknown	https://doi.org/10.1248/CPB.46.1587
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids
(6Z)-3,7-dimethylnona-1,6-dien-3-ol	22825880	Click to see CCC(=CCCC(C)(C=C)O)C	168.28	unknown	via CMAUP database
(Z)-alpha-ocimene	5463455	Click to see CC(=C)CCC=C(C)C=C	136.23	unknown	https://doi.org/10.1055/S-2000-9773
2,6-Dimethyl-2,4,6-octatriene	5368821	Click to see CC=C(C)C=CC=C(C)C	136.23	unknown	via CMAUP database
5,9-Dimethyldeca-3,8-dien-5-ol	121513943	Click to see CCC=CC(C)(CCC=C(C)C)O	182.30	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6268697/
beta-CITRONELLOL, (+/-)-	8842	Click to see CC(CCC=C(C)C)CCO	156.26	unknown	https://doi.org/10.1007/BF02860485
beta-Ocimene	18756	Click to see CC(=CCC=C(C)C=C)C	136.23	unknown	via CMAUP database
beta-OCIMENE, (3E)-	5281553	Click to see CC(=CCC=C(C)C=C)C	136.23	unknown	via CMAUP database
beta-Ocimene, (3Z)-	5320250	Click to see CC(=CCC=C(C)C=C)C	136.23	unknown	https://doi.org/10.1080/10412905.1992.9698137
Ethyl linalool	6433547	Click to see CCC(=CCCC(C)(C=C)O)C	168.28	unknown	via CMAUP database
Geraniol	637566	Click to see CC(=CCCC(=CCO)C)C	154.25	unknown	https://doi.org/10.1007/BF02860485
Linalool, (-)-	443158	Click to see CC(=CCCC(C)(C=C)O)C	154.25	unknown	via CMAUP database
Linalool, (+)-	67179	Click to see CC(=CCCC(C)(C=C)O)C	154.25	unknown	via CMAUP database
Linalool, (+/-)-	6549	Click to see CC(=CCCC(C)(C=C)O)C	154.25	unknown	via CMAUP database
Myrcene	31253	Click to see CC(=CCCC(=C)C=C)C	136.23	unknown	https://doi.org/10.1080/10412905.1992.9698137 https://doi.org/10.1055/S-0028-1099968 https://doi.org/10.1080/10412905.1993.9698207 https://doi.org/10.1080/10412905.1994.9698394
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Aromatic monoterpenoids
3-(4-Isopropylphenyl)-2-methylpropanal	517827	Click to see CC(C)C1=CC=C(C=C1)CC(C)C=O	190.28	unknown	via CMAUP database
3-p-Isopropylphenyl-3-methylpropanal	7687	Click to see CC(C)C1=CC=C(C=C1)C(C)CC=O	190.28	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6268697/
Carvacrol	10364	Click to see CC1=C(C=C(C=C1)C(C)C)O	150.22	unknown	via CMAUP database
Cuminaldehyde	326	Click to see CC(C)C1=CC=C(C=C1)C=O	148.20	unknown	via CMAUP database
Cyclamen aldehyde, (R)-	40152681	Click to see CC(C)C1=CC=C(C=C1)CC(C)C=O	190.28	unknown	via CMAUP database
Cyclamen aldehyde, (S)-	40152682	Click to see CC(C)C1=CC=C(C=C1)CC(C)C=O	190.28	unknown	via CMAUP database
p-CYMENE	7463	Click to see CC1=CC=C(C=C1)C(C)C	134.22	unknown	https://doi.org/10.1211/0022357991777218 https://doi.org/10.1080/10412905.1992.9698137 https://doi.org/10.1055/S-0028-1099968 https://doi.org/10.1080/10412905.1993.9698207 https://doi.org/10.1016/J.JPBA.2006.01.024 https://doi.org/10.1080/10412905.1994.9698394
Thymohydroquinone	95779	Click to see CC1=CC(=C(C=C1O)C(C)C)O	166.22	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6268697/
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids
(-)-3-Carene	442461	Click to see CC1=CCC2C(C1)C2(C)C	136.23	unknown	via CMAUP database
(-)-beta-Pinene	440967	Click to see CC1(C2CCC(=C)C1C2)C	136.23	unknown	https://doi.org/10.1055/S-0028-1099968
(-)-Camphene	440966	Click to see CC1(C2CCC(C2)C1=C)C	136.23	unknown	via CMAUP database
(-)-Camphor	444294	Click to see CC1(C2CCC1(C(=O)C2)C)C	152.23	unknown	via CMAUP database
(-)-Fenchone	82229	Click to see CC1(C2CCC(C2)(C1=O)C)C	152.23	unknown	https://doi.org/10.1211/0022357991777218
(-)-Sabinene	11051711	Click to see CC(C)C12CCC(=C)C1C2	136.23	unknown	via CMAUP database
(-)-Verbenone	92874	Click to see CC1=CC(=O)C2CC1C2(C)C	150.22	unknown	via CMAUP database
(+)-3-Carene	443156	Click to see CC1=CCC2C(C1)C2(C)C	136.23	unknown	via CMAUP database
(+)-4-Carene	71351627	Click to see CC1CC2C(C2(C)C)C=C1	136.23	unknown	via CMAUP database
(+)-alpha-Pinene	82227	Click to see CC1=CCC2CC1C2(C)C	136.23	unknown	https://doi.org/10.1021/JF049033E
(+)-alpha-Thujone	12304612	Click to see CC1C2CC2(CC1=O)C(C)C	152.23	unknown	via CMAUP database
(+)-Bornyl acetate	6950274	Click to see CC(=O)OC1CC2CCC1(C2(C)C)C	196.29	unknown	via CMAUP database
(+)-Camphene	92221	Click to see CC1(C2CCC(C2)C1=C)C	136.23	unknown	via CMAUP database
(+)-Camphor	9543187	Click to see CC1(C2CCC1(C(=O)C2)C)C	152.23	unknown	via CMAUP database
(+)-Fenchone	1201521	Click to see CC1(C2CCC(C2)(C1=O)C)C	152.23	unknown	https://doi.org/10.1021/JF020504B https://doi.org/10.1002/PS.274 https://doi.org/10.1021/JF049631T
(1R,2S,4R)-(+)-Bornyl acetate	443131	Click to see CC(=O)OC1CC2CCC1(C2(C)C)C	196.29	unknown	via CMAUP database
(1R,4R,6R)-1,3,3-Trimethyl-2-oxabicyclo[2.2.2]octane-4,6-diol	10655153	Click to see CC1(C2(CCC(O1)(C(C2)O)C)O)C	186.25	unknown	https://doi.org/10.1248/CPB.44.337
(1R)-endo-(+)-Fenchyl alcohol	6997371	Click to see CC1(C2CCC(C2)(C1O)C)C	154.25	unknown	https://doi.org/10.1080/10412905.1993.9698207
(1S,2R,4S)-(-)-Bornyl acetate	442460	Click to see CC(=O)OC1CC2CCC1(C2(C)C)C	196.29	unknown	via CMAUP database
(1S,4S,6R)-1,3,3-trimethyl-2-oxabicyclo[2.2.2]octane-4,6-diol	10487795	Click to see CC1(C2(CCC(O1)(C(C2)O)C)O)C	186.25	unknown	https://doi.org/10.1248/CPB.44.337
(1S)-1,3,3-Trimethylbicyclo[2.2.1]heptan-2-one	12049113	Click to see CC1(C2CCC(C2)(C1=O)C)C	152.23	unknown	via CMAUP database
(1S)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene	12223113	Click to see CC1=CCC2CC1C2(C)C	136.23	unknown	via CMAUP database
(4R)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-one	16213045	Click to see CC1(C2CCC(C2)(C1=O)C)C	152.23	unknown	via CMAUP database
(R)-(+)-fenchyl acetate	22831486	Click to see CC(=O)OC1C(C2CCC1(C2)C)(C)C	196.29	unknown	via CMAUP database
(R)-Fenchone; L-(-)-Fenchone; L-Fenchone; l-Fenchone	2794921	Click to see CC1(C2CCC(C2)(C1=O)C)C	152.23	unknown	via CMAUP database
(S)-cis-Verbenol	87839	Click to see CC1=CC(C2CC1C2(C)C)O	152.23	unknown	via CMAUP database
1,3,3-Trimethyl-2-oxabicyclo[2.2.2]octane-4,6-diol	188642	Click to see CC1(C2(CCC(O1)(C(C2)O)C)O)C	186.25	unknown	https://doi.org/10.1248/CPB.44.337
2-Fenchanol	91746490	Click to see CC1(C2CCC(C2)(C1O)C)C	154.25	unknown	via CMAUP database
2,6,6-Trimethyl-bicyclo[3.1.1]heptane, trans	91015300	Click to see CC1CCC2CC1C2(C)C	138.25	unknown	via CMAUP database
3-Carene	26049	Click to see CC1=CCC2C(C1)C2(C)C	136.23	unknown	via CMAUP database
4,7,7-Trimethylbicyclo[4.1.0]hept-2-ene	530422	Click to see CC1CC2C(C2(C)C)C=C1	136.23	unknown	via CMAUP database
alpha-Bergamotenol	5368743	Click to see CC1=CCC2CC1C2(C)CCC=C(C)CO	220.35	unknown	via CMAUP database
alpha-CIS-BERGAMOTENE	6429303	Click to see CC1=CCC2CC1C2(C)CCC=C(C)C	204.35	unknown	via CMAUP database
alpha-Fenchene	28930	Click to see CC1(C2CCC1C(=C)C2)C	136.23	unknown	via CMAUP database
alpha-Fenchol	439711	Click to see CC1(C2CCC(C2)(C1O)C)C	154.25	unknown	https://doi.org/10.1016/0003-9861(89)90134-3
alpha-Fenchyl acetate	6427102	Click to see CC(=O)OC1C(C2CCC1(C2)C)(C)C	196.29	unknown	via CMAUP database
alpha-PINENE	6654	Click to see CC1=CCC2CC1C2(C)C	136.23	unknown	https://doi.org/10.1055/S-2006-962632 https://doi.org/10.1016/S0305-1978(96)00106-8 https://doi.org/10.1016/J.ARABJC.2010.11.006 https://doi.org/10.1080/10412905.1992.9698137 https://doi.org/10.1079/9781845934057.0227 https://doi.org/10.1055/S-2000-9773 https://doi.org/10.1080/10412905.1993.9698207 https://doi.org/10.1080/10412905.1994.9698394
alpha-Pinene oxide	91508	Click to see CC1(C2CC1C3(C(C2)O3)C)C	152.23	unknown	via CMAUP database
alpha-Thujone	12304613	Click to see CC1C2CC2(CC1=O)C(C)C	152.23	unknown	via CMAUP database
beta-Fenchyl alcohol	6973643	Click to see CC1(C2CCC(C2)(C1O)C)C	154.25	unknown	via CMAUP database
beta-Pinene	14896	Click to see CC1(C2CCC(=C)C1C2)C	136.23	unknown	https://doi.org/10.1055/S-2006-962632 https://doi.org/10.1080/10412905.1992.9698137 https://doi.org/10.1055/S-0028-1099968 https://doi.org/10.1055/S-2000-9773 https://doi.org/10.1080/10412905.1993.9698207 https://doi.org/10.1007/BF02860485
Bicyclo[2.2.1]heptan-2-one, 1,3,3-trimethyl-, (1S)-	3034206	Click to see CC1(C2CCC(C2)(C1=O)C)C	152.23	unknown	via CMAUP database
Bicyclo[3.1.0]hex-2-ene, 2-methyl-5-(1-methylethyl)-	17868	Click to see CC1=CCC2(C1C2)C(C)C	136.23	unknown	via CMAUP database
Bicyclo[3.1.1]hept-3-en-2-ol, 4,6,6-trimethyl-, [1S-(1alpha,2beta,5alpha)]-	2734021	Click to see CC1=CC(C2CC1C2(C)C)O	152.23	unknown	via CMAUP database
Bornyl acetate	6448	Click to see CC(=O)OC1CC2CCC1(C2(C)C)C	196.29	unknown	via CMAUP database
Bornyl acetate, (-)-	93009	Click to see CC(=O)OC1CC2CCC1(C2(C)C)C	196.29	unknown	via CMAUP database
Camphene	6616	Click to see CC1(C2CCC(C2)C1=C)C	136.23	unknown	https://doi.org/10.1016/J.ARABJC.2010.11.006 https://doi.org/10.1080/10412905.1992.9698137 https://doi.org/10.1079/9781845934057.0227 https://doi.org/10.1080/10412905.1993.9698207
Camphor	2537	Click to see CC1(C2CCC1(C(=O)C2)C)C	152.23	unknown	https://doi.org/10.1080/10412905.1992.9698137 https://doi.org/10.1016/J.ARABJC.2010.11.006
Camphor (synthetic)	159055	Click to see CC1(C2CCC1(C(=O)C2)C)C	152.23	unknown	via CMAUP database
Camphor, (1S,4S)-(-)-	10050	Click to see CC1(C2CCC1(C(=O)C2)C)C	152.23	unknown	via CMAUP database
cis-Sabinene hydrate	11744854	Click to see CC(C)C12CCC(C1C2)(C)O	154.25	unknown	via CMAUP database
cis-Verbenol	164888	Click to see CC1=CC(C2CC1C2(C)C)O	152.23	unknown	via CMAUP database
d-Camphor	230921	Click to see CC1(C2CCC1(C(=O)C2)C)C	152.23	unknown	via CMAUP database
Fenchol	15406	Click to see CC1(C2CCC(C2)(C1O)C)C	154.25	unknown	https://doi.org/10.1079/9781845934057.0227
Fenchone	14525	Click to see CC1(C2CCC(C2)(C1=O)C)C	152.23	unknown	https://doi.org/10.1021/JF020504B https://doi.org/10.1016/S0305-1978(96)00106-8 https://doi.org/10.1055/S-2006-962632 https://doi.org/10.1055/S-2006-962631 https://doi.org/10.1002/PS.274 https://doi.org/10.1080/10412905.1994.9698394 https://doi.org/10.1211/0022357991777218 https://doi.org/10.1080/10412905.1993.9698207 https://doi.org/10.1080/10412905.1992.9698137 https://doi.org/10.1079/9781845934057.0227 https://doi.org/10.1055/S-2000-9773 https://doi.org/10.1021/JF049631T
Fenchyl acetate	107217	Click to see CC(=O)OC1C(C2CCC1(C2)C)(C)C	196.29	unknown	https://doi.org/10.1080/10412905.1992.9698137 https://doi.org/10.1016/J.ARABJC.2010.11.006
L-Born-2-yl acetate	44630108	Click to see CC(=O)OC1CC2CCC1(C2(C)C)C	196.29	unknown	via CMAUP database
Sabinen	18818	Click to see CC(C)C12CCC(=C)C1C2	136.23	unknown	https://doi.org/10.1080/10412905.1994.9698394 https://doi.org/10.1080/10412905.1992.9698137 https://doi.org/10.1016/S0305-1978(96)00106-8
Sabinene	10887971	Click to see CC(C)C12CCC(=C)C1C2	136.23	unknown	via CMAUP database
Sabinene hydrate	62367	Click to see CC(C)C12CCC(C1C2)(C)O	154.25	unknown	via CMAUP database
Sabinene hydrate isomer	67159878	Click to see CC(C)C12CCC(C1C2)(C)O	154.25	unknown	via CMAUP database
trans-Sabinene hydrate	12315151	Click to see CC(C)C12CCC(C1C2)(C)O	154.25	unknown	via CMAUP database
trans-Sabinenehydrate	6431628	Click to see CC(C)C12CCC(C1C2)(C)O	154.25	unknown	via CMAUP database
Verbenol	61126	Click to see CC1=CC(C2CC1C2(C)C)O	152.23	unknown	via CMAUP database
Verbenone	29025	Click to see CC1=CC(=O)C2CC1C2(C)C	150.22	unknown	via CMAUP database
Verbenone, (+)-	65724	Click to see CC1=CC(=O)C2CC1C2(C)C	150.22	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Menthane monoterpenoids
(-)-cis-Carveol	330573	Click to see CC1=CCC(CC1O)C(=C)C	152.23	unknown	via CMAUP database
(-)-Pulegone	638012	Click to see CC1CCC(=C(C)C)C(=O)C1	152.23	unknown	via CMAUP database
(-)-Terpinen-4-ol	5325830	Click to see CC1=CCC(CC1)(C(C)C)O	154.25	unknown	via CMAUP database
(-)-trans-Carveol	94221	Click to see CC1=CCC(CC1O)C(=C)C	152.23	unknown	https://doi.org/10.1080/10412905.1992.9698137
(+)-alpha-Phellandrene	443160	Click to see CC1=CCC(C=C1)C(C)C	136.23	unknown	via CMAUP database
(+)-cis-Carveol	443177	Click to see CC1=CCC(CC1O)C(=C)C	152.23	unknown	via CMAUP database
(+)-Terpinen-4-ol	2724161	Click to see CC1=CCC(CC1)(C(C)C)O	154.25	unknown	via CMAUP database
(1R,2R,5S)-2-methyl-5-propan-2-ylcyclohex-3-ene-1,2-diol	100616623	Click to see CC(C)C1CC(C(C=C1)(C)O)O	170.25	unknown	https://doi.org/10.4067/S0717-97072011000300008
(1R,4R,5R)-2-methyl-5-propan-2-ylcyclohex-2-ene-1,4-diol	124355567	Click to see CC1=CC(C(CC1O)C(C)C)O	170.25	unknown	https://doi.org/10.4067/S0717-97072011000300008
(1S,2S,4S,5R)-2-methyl-5-propan-2-ylcyclohexane-1,2,4-triol	162829292	Click to see CC(C)C1CC(C(CC1O)(C)O)O	188.26	unknown	https://doi.org/10.4067/S0717-97072011000300008
(3r,4r,6s)-3,6-Dihydroxy-1-menthene	10374851	Click to see CC1=CC(C(CC1O)C(C)C)O	170.25	unknown	https://doi.org/10.4067/S0717-97072011000300008
(4R,5R)-4-hydroxy-2-methyl-5-propan-2-ylcyclohex-2-en-1-one	15939501	Click to see CC1=CC(C(CC1=O)C(C)C)O	168.23	unknown	https://doi.org/10.4067/S0717-97072011000300008
(4R,5S)-4-hydroxy-2-methyl-5-propan-2-ylcyclohex-2-en-1-one	44234541	Click to see CC1=CC(C(CC1=O)C(C)C)O	168.23	unknown	https://doi.org/10.4067/S0717-97072011000300008
(4S,6S)-4-hydroxy-3-methyl-6-propan-2-ylcyclohex-2-en-1-one	130858490	Click to see CC1=CC(=O)C(CC1O)C(C)C	168.23	unknown	https://doi.org/10.4067/S0717-97072011000300008
1-Methyl-4-((hydroxymethyl)vinyl)-cyclohex-1-ene	11019061	Click to see CC1=CCC(CC1)C(=C)CO	152.23	unknown	via CMAUP database
2-Cyclohexen-1-ol, 1-methyl-4-(1-methylethenyl)-, trans-	12618691	Click to see CC(=C)C1CCC(C=C1)(C)O	152.23	unknown	via CMAUP database
2-Cyclohexen-1-one, 4-hydroxy-3-methyl-6-(1-methylethyl)-	566981	Click to see CC1=CC(=O)C(CC1O)C(C)C	168.23	unknown	https://doi.org/10.4067/S0717-97072011000300008
2-Cyclohexen-1-one, 4-hydroxy-3-methyl-6-(1-methylethyl)-, trans-	22215384	Click to see CC1=CC(=O)C(CC1O)C(C)C	168.23	unknown	https://doi.org/10.4067/S0717-97072011000300008
2-Methyl-5-propan-2-ylcyclohex-2-en-1-one	521267	Click to see CC1=CCC(CC1=O)C(C)C	152.23	unknown	https://doi.org/10.1016/J.JPBA.2006.01.024
2-Methyl-5-propan-2-ylcyclohexane-1,2,3,4-tetrol	73001227	Click to see CC(C)C1CC(C(C(C1O)O)(C)O)O	204.26	unknown	https://doi.org/10.4067/S0717-97072011000300008
2-Methyl-5beta-isopropyl-1alpha,2beta,3beta,4alpha-cyclohexanetetraol	11542987	Click to see CC(C)C1CC(C(C(C1O)O)(C)O)O	204.26	unknown	https://doi.org/10.4067/S0717-97072011000300008
3-Hydroxy-p-menth-1-en-6-one	14106048	Click to see CC1=CC(C(CC1=O)C(C)C)O	168.23	unknown	https://doi.org/10.4067/S0717-97072011000300008
4-Hydroxy-6-isopropyl-3-methyl-2-cyclohexen-1-one	91701091	Click to see CC1=CC(=O)C(CC1O)C(C)C	168.23	unknown	https://doi.org/10.4067/S0717-97072011000300008
4-Methyl-beta-methylenecyclohex-3-ene-1-ethanol	527143	Click to see CC1=CCC(CC1)C(=C)CO	152.23	unknown	via CMAUP database
4-Terpineol, (+/-)-	11230	Click to see CC1=CCC(CC1)(C(C)C)O	154.25	unknown	https://doi.org/10.1080/10412905.1992.9698137
5-Isopropyl-2-methylcyclohex-2-ene-1,4-diol	13919076	Click to see CC1=CC(C(CC1O)C(C)C)O	170.25	unknown	https://doi.org/10.4067/S0717-97072011000300008
5-p-Menthene-1,2-diol	14736609	Click to see CC(C)C1CC(C(C=C1)(C)O)O	170.25	unknown	https://doi.org/10.4067/S0717-97072011000300008
6beta-Hydroxypiperitone	45096419	Click to see CC1=CC(=O)C(CC1O)C(C)C	168.23	unknown	https://doi.org/10.4067/S0717-97072011000300008
alpha-PHELLANDRENE	7460	Click to see CC1=CCC(C=C1)C(C)C	136.23	unknown	https://doi.org/10.1080/10412905.1994.9698394 https://doi.org/10.1080/10412905.1993.9698207 https://doi.org/10.1080/10412905.1992.9698137 https://doi.org/10.1016/S0305-1978(96)00106-8 https://doi.org/10.1055/S-2006-962632
alpha-Terpinene	7462	Click to see CC1=CC=C(CC1)C(C)C	136.23	unknown	via CMAUP database
Beta-Phellandrene	11142	Click to see CC(C)C1CCC(=C)C=C1	136.23	unknown	https://doi.org/10.1016/S0305-1978(96)00106-8
Carveol	7438	Click to see CC1=CCC(CC1O)C(=C)C	152.23	unknown	https://doi.org/10.1080/10412905.1992.9698137
Carvone, (-)-	439570	Click to see CC1=CCC(CC1=O)C(=C)C	150.22	unknown	via CMAUP database
Carvone, (+)-	16724	Click to see CC1=CCC(CC1=O)C(=C)C	150.22	unknown	https://doi.org/10.1080/10412905.1992.9698137
Carvone, (+/-)-	7439	Click to see CC1=CCC(CC1=O)C(=C)C	150.22	unknown	https://doi.org/10.1080/10412905.1992.9698137
cis-5-Hydroxy-p-menth-1(6)-en-2-one	6429208	Click to see CC1=CC(C(CC1=O)C(C)C)O	168.23	unknown	https://doi.org/10.4067/S0717-97072011000300008
Cyclohexene, 1-methyl-4-(1-methylethyl)-	21671	Click to see CC1=CCC(CC1)C(C)C	138.25	unknown	https://doi.org/10.1016/J.JPBA.2006.01.024
d-Piperitone	61362	Click to see CC1=CC(=O)C(CC1)C(C)C	152.23	unknown	via CMAUP database
l-Piperitone	107561	Click to see CC1=CC(=O)C(CC1)C(C)C	152.23	unknown	via CMAUP database
Limonene, (-)-	439250	Click to see CC1=CCC(CC1)C(=C)C	136.23	unknown	https://doi.org/10.1021/JF049033E
Limonene, (+)-	440917	Click to see CC1=CCC(CC1)C(=C)C	136.23	unknown	https://doi.org/10.1021/JF049033E
Limonene, (+/-)-	22311	Click to see CC1=CCC(CC1)C(=C)C	136.23	unknown	https://doi.org/10.1055/S-2006-962632 https://doi.org/10.1016/S0305-1978(96)00106-8 https://doi.org/10.1016/J.ARABJC.2010.11.006 https://doi.org/10.1080/10412905.1992.9698137 https://doi.org/10.1079/9781845934057.0227 https://doi.org/10.1055/S-2000-9773 https://doi.org/10.1080/10412905.1993.9698207 https://doi.org/10.1080/10412905.1994.9698394
p-Menth-4(8)-en-3-one	6988	Click to see CC1CCC(=C(C)C)C(=O)C1	152.23	unknown	via CMAUP database
p-Menth-6-en-2-ol, (2S,4S)-(+)-	534485	Click to see CC1=CCC(CC1O)C(C)C	154.25	unknown	https://doi.org/10.1016/J.JPBA.2006.01.024
P-Mentha-2,8-dien-1-ol	155626	Click to see CC(=C)C1CCC(C=C1)(C)O	152.23	unknown	via CMAUP database
Piperitenone	381152	Click to see CC1=CC(=O)C(=C(C)C)CC1	150.22	unknown	https://doi.org/10.1080/10412905.1994.9698394
Piperitone	6987	Click to see CC1=CC(=O)C(CC1)C(C)C	152.23	unknown	via CMAUP database
Pulegone	442495	Click to see CC1CCC(=C(C)C)C(=O)C1	152.23	unknown	via CMAUP database
Terpinolene	11463	Click to see CC1=CCC(=C(C)C)CC1	136.23	unknown	https://doi.org/10.1080/10412905.1994.9698394
trans-5-Hydroxy-p-menth-1(6)-en-2-one	6429209	Click to see CC1=CC(C(CC1=O)C(C)C)O	168.23	unknown	https://doi.org/10.4067/S0717-97072011000300008
> Lipids and lipid-like molecules / Prenol lipids / Quinone and hydroquinone lipids / Vitamin E compounds / Tocotrienols
gamma-Tocotrienol	5282349	Click to see CC1=C(C=C2CCC(OC2=C1C)(C)CCC=C(C)CCC=C(C)CCC=C(C)C)O	410.60	unknown	https://doi.org/10.1079/9781845934057.0227
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
(+)-beta-Caryophyllene	20831623	Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C	204.35	unknown	via CMAUP database
(+)-gamma-Cadinene	6432404	Click to see CC1=CC2C(CC1)C(=C)CCC2C(C)C	204.35	unknown	via CMAUP database
(+)-Nerolidol	5356544	Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C	222.37	unknown	via CMAUP database
(+)(-)-(E)-beta-caryophyllene	14757966	Click to see CC1(CC2C1CCC(=C)CCCC2=C)C	204.35	unknown	via CMAUP database
(3R,6E)-nerolidol	11241545	Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C	222.37	unknown	via CMAUP database
(3S,6E)-Nerolidol	5281525	Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C	222.37	unknown	via CMAUP database
(4Z)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene	5322111	Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C	204.35	unknown	via CMAUP database
(E)-beta-farnesene	10407	Click to see CC(=CCCC(=CCCC(=C)C=C)C)C	204.35	unknown	via CMAUP database
(R)-3-Methylene-6-((S)-1,2,2-trimethylcyclopentyl)cyclohex-1-ene	25202927	Click to see CC1(CCCC1(C)C2CCC(=C)C=C2)C	204.35	unknown	via CMAUP database
(Z)-caryophyllene	6429301	Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C	204.35	unknown	via CMAUP database
1-epi-Bicyclosesquiphellandrene	521496	Click to see CC1CCC(C2=CC(=C)CCC12)C(C)C	204.35	unknown	via CMAUP database
1-Methyl-4-(6-methylhepta-1,5-dien-2-yl)cyclohex-1-ene	403919	Click to see CC1=CCC(CC1)C(=C)CCC=C(C)C	204.35	unknown	via CMAUP database
1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, (3R,6Z)-	12227246	Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C	222.37	unknown	via CMAUP database
3a(1H)-Azulenol, 2,3,4,5,8,8a-hexahydro-6,8a-dimethyl-3-(1-methylethyl)-, [3R-(3alpha,3aalpha,8aalpha)]-	6432448	Click to see CC1=CCC2(CCC(C2(CC1)O)C(C)C)C	222.37	unknown	via CMAUP database
3aalpha(1H)-Azulenol, 2,3,4,5,8,8a-hexahydro-3alpha-isopropyl-6,8aalpha-dimethyl-, (+)-	287687	Click to see CC1=CCC2(CCC(C2(CC1)O)C(C)C)C	222.37	unknown	via CMAUP database
4-Isopropenyl-5-methyl-2-(1-methylethylidene)-5-vinylcyclohexanone	519762	Click to see CC(=C1CC(C(CC1=O)(C)C=C)C(=C)C)C	218.33	unknown	via CMAUP database
4,11,11-Trimethyl-8-methylene-5-oxatricyclo(8.2.0.0(4,6))dodecane, (1R,4R,6R,10S)-	6604672	Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C	220.35	unknown	via CMAUP database
6,10,14-Trimethylpentadecan-2-one	10408	Click to see CC(C)CCCC(C)CCCC(C)CCCC(=O)C	268.50	unknown	via CMAUP database
beta-(Z)-Elemenone	22211636	Click to see CC(=C1CC(C(CC1=O)(C)C=C)C(=C)C)C	218.33	unknown	via CMAUP database
beta-Bisabolene	10104370	Click to see CC1=CCC(CC1)C(=C)CCC=C(C)C	204.35	unknown	via CMAUP database
beta-Elemenone	10955018	Click to see CC(=C1CC(C(CC1=O)(C)C=C)C(=C)C)C	218.33	unknown	via CMAUP database
beta-Farnesene	5281517	Click to see CC(=CCCC(=CCCC(=C)C=C)C)C	204.35	unknown	via CMAUP database
beta-Farnesene, (6Z)-	5317319	Click to see CC(=CCCC(=CCCC(=C)C=C)C)C	204.35	unknown	via CMAUP database
Carotol	442347	Click to see CC1=CCC2(CCC(C2(CC1)O)C(C)C)C	222.37	unknown	via CMAUP database
Caryophyllene	5281515	Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C	204.35	unknown	via CMAUP database
Caryophyllene epoxide	14350	Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C	220.35	unknown	via CMAUP database
Caryophyllene,alpha + beta mixt.	5354499	Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C	204.35	unknown	via CMAUP database
cis-Nerolidol	5320128	Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C	222.37	unknown	via CMAUP database
delta-Cadinene	12306054	Click to see CC1=CC2C(CCC(=C2CC1)C)C(C)C	204.35	unknown	via CMAUP database
Farnesyl acetate	638500	Click to see CC(=CCCC(=CCCC(=CCOC(=O)C)C)C)C	264.40	unknown	via CMAUP database
gamma-Bisabolene, (Z)-	3033866	Click to see CC1=CCC(=C(C)CCC=C(C)C)CC1	204.35	unknown	via CMAUP database
Humulene	5281520	Click to see CC1=CCC(C=CCC(=CCC1)C)(C)C	204.35	unknown	https://doi.org/10.1007/BF02860485
Isocaryophyllene	5281522	Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C	204.35	unknown	via CMAUP database
Naphthalene, 1,2,3,5,6,8a-hexahydro-4,7-dimethyl-1-(1-methylethyl)-, (1S-cis)-	12306059	Click to see CC1=CC2C(CCC(=C2CC1)C)C(C)C	204.35	unknown	via CMAUP database
Nerolidol	8888	Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C	222.37	unknown	via CMAUP database
trans-Muurola-4(14),5-diene	91747125	Click to see CC1CCC(C2=CC(=C)CCC12)C(C)C	204.35	unknown	via CMAUP database
trans-Nerolidol	5284507	Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C	222.37	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Agarofurans
[(1R,9R)-6,10,10-trimethyl-11-oxatricyclo[7.2.1.01,6]dodec-2-en-2-yl]methanol	5316435	Click to see CC1(C2CCC3(CCC=C(C3(C2)O1)CO)C)C	236.35	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Aromadendrane sesquiterpenoids / 5,10-cycloaromadendrane sesquiterpenoids
(-)-Globulol	12304985	Click to see CC1CCC2C1C3C(C3(C)C)CCC2(C)O	222.37	unknown	via CMAUP database
(+)-Globulol	12304982	Click to see CC1CCC2C1C3C(C3(C)C)CCC2(C)O	222.37	unknown	via CMAUP database
(1aR,4R,4aR,7R,7aS,7bS)-1,1,4,7-Tetramethyldecahydro-1H-cyclopropa[e]azulen-4-ol	91746597	Click to see CC1CCC2C1C3C(C3(C)C)CCC2(C)O	222.37	unknown	via CMAUP database
1H-Cycloprop[e]azulen-4-ol, decahydro-1,1,4,7-tetramethyl-, [1ar-(1aalpha,4beta,4abeta,7alpha,7abeta,7balpha)]-	6432543	Click to see CC1CCC2C1C3C(C3(C)C)CCC2(C)O	222.37	unknown	via CMAUP database
Globulol	101716	Click to see CC1CCC2C1C3C(C3(C)C)CCC2(C)O	222.37	unknown	via CMAUP database
Viridiflorol	11996452	Click to see CC1CCC2C1C3C(C3(C)C)CCC2(C)O	222.37	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Cedrane and isocedrane sesquiterpenoids
Cedrol	65575	Click to see CC1CCC2C13CCC(C(C3)C2(C)C)(C)O	222.37	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eudesmane, isoeudesmane or cycloeudesmane sesquiterpenoids
2-(4a-Methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)propan-2-ol	521215	Click to see CC12CCCC(=C)C1CC(CC2)C(C)(C)O	222.37	unknown	via CMAUP database
2-Naphthalenemethanol, decahydro-alpha,alpha,4a-trimethyl-8-methylene-, [2R-(2alpha,4aalpha,8abeta)]-	6432456	Click to see CC12CCCC(=C)C1CC(CC2)C(C)(C)O	222.37	unknown	via CMAUP database
beta-EUDESMOL	91457	Click to see CC12CCCC(=C)C1CC(CC2)C(C)(C)O	222.37	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Germacrane sesquiterpenoids
(+)-germacrene D	24771782	Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C	204.35	unknown	via CMAUP database
(1E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene	74764030	Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C	204.35	unknown	via CMAUP database
(1Z)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene	92003564	Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C	204.35	unknown	via CMAUP database
(6E,8S)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene	49796490	Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C	204.35	unknown	via CMAUP database
1-Hydroxy-1,7-dimethyl-4-isopropyl-2,7-cyclodecadiene	5367550	Click to see CC1=CCCC(C=CC(CC1)C(C)C)(C)O	222.37	unknown	via CMAUP database
1-Methyl-5-methylene-8-(1-methylethyl)-1,6-cyclodecadiene	6436582	Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C	204.35	unknown	via CMAUP database
1,6-Cyclodecadiene, 1-methyl-5-methylene-8-(1-methylethyl)-, [s-(E,E)]-	5373727	Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C	204.35	unknown	via CMAUP database
Germacrene D	5317570	Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C	204.35	unknown	via CMAUP database
Germacrene D-4-ol	5352847	Click to see CC1=CCCC(C=CC(CC1)C(C)C)(C)O	222.37	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[[(1R,4R,6R)-4-hydroxy-1,3,3-trimethyl-2-oxabicyclo[2.2.2]octan-6-yl]oxy]oxane-3,4,5-triol	10783914	Click to see CC1(C2(CCC(O1)(C(C2)OC3C(C(C(C(O3)CO)O)O)O)C)O)C	348.39	unknown	https://doi.org/10.1248/CPB.44.337
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[[(1R,4R,6R)-6-hydroxy-1,3,3-trimethyl-2-oxabicyclo[2.2.2]octan-4-yl]oxy]oxane-3,4,5-triol	10712710	Click to see CC1(C2(CCC(O1)(C(C2)O)C)OC3C(C(C(C(O3)CO)O)O)O)C	348.39	unknown	https://doi.org/10.1248/CPB.44.337
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[[(1S,4S,6R)-4-hydroxy-1,3,3-trimethyl-2-oxabicyclo[2.2.2]octan-6-yl]oxy]oxane-3,4,5-triol	10831566	Click to see CC1(C2(CCC(O1)(C(C2)OC3C(C(C(C(O3)CO)O)O)O)C)O)C	348.39	unknown	https://doi.org/10.1248/CPB.44.337
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[[(1S,4S,6S)-4-hydroxy-1,3,3-trimethyl-2-oxabicyclo[2.2.2]octan-6-yl]oxy]oxane-3,4,5-triol	10569725	Click to see CC1(C2(CCC(O1)(C(C2)OC3C(C(C(C(O3)CO)O)O)O)C)O)C	348.39	unknown	https://doi.org/10.1248/CPB.44.337
1,8-Epoxy-p-menthan-4-ol glucoside	85266295	Click to see CC1(C2(CCC(O1)(CC2)C)OC3C(C(C(C(O3)CO)O)O)O)C	332.39	unknown	https://doi.org/10.1248/CPB.44.337
Foeniculoside V	73657190	Click to see CC1(C2(CCC(O1)(C(C2)OC3C(C(C(C(O3)CO)O)O)O)C)O)C	348.39	unknown	https://doi.org/10.1248/CPB.44.337 https://doi.org/10.1248/CPB.46.1738
Foeniculoside VII	73657191	Click to see CC1(C2(CCC(O1)(C(C2)O)C)OC3C(C(C(C(O3)CO)O)O)O)C	348.39	unknown	https://doi.org/10.1248/CPB.44.337 https://doi.org/10.1248/CPB.46.1738
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Iridoid O-glycosides
(E)-6-O-(p-coumaroyl)scandoside methyl ester	145874216	Click to see COC(=O)C1=COC(C2C1C(C=C2CO)OC(=O)C=CC3=CC=C(C=C3)O)OC4C(C(C(C(O4)CO)O)O)O	550.50	unknown	https://doi.org/10.1248/CPB.43.868
[(1S,4aR,7S,7aS)-7-hydroxy-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-5-yl] (Z)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate	6325178	Click to see CC1(CC(C2C1C(OC=C2)OC3C(C(C(C(O3)CO)O)O)O)OC(=O)C=CC4=CC(=C(C=C4)O)OC)O	524.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Triterpene glycosides / Triterpene saponins
(Z)-Senegin III	101990870	Click to see CC1C(C(C(C(O1)OC2C(C(OC(C2OC3C(C(C(C(O3)C)OC4C(C(C(CO4)OC5C(C(C(C(O5)CO)O)O)O)O)O)O)O)OC(=O)C67CCC(CC6C8=CCC9C(C8(CC7)CO)(CCC1C9(CC(C(C1(C)C(=O)O)OC1C(C(C(C(O1)CO)O)O)O)O)C)C)(C)C)C)OC(=O)C=CC1=CC=C(C=C1)OC)O)O)O	1573.70	unknown	via CMAUP database
2beta,27-Dihydroxy-3beta-(beta-D-glucopyranosyloxy)olean-12-ene-23,28-dioic acid 28-[2-O-[4-O-(4-O-beta-D-galactopyranosyl-beta-D-xylopyranosyl)-alpha-L-rhamnopyranosyl]-4-O-(3,4-dimethoxy-cis-cinnamoyl)-beta-D-fucopyranosyl] ester	101941091	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC(=O)C34CCC(CC3C5=CCC6C(C5(CC4)CO)(CCC7C6(CC(C(C7(C)C(=O)O)OC8C(C(C(C(O8)CO)O)O)O)O)C)C)(C)C)C)OC(=O)C=CC9=CC(=C(C=C9)OC)OC)O)O)O)OC1C(C(C(CO1)OC1C(C(C(C(O1)CO)O)O)O)O)O	1457.60	unknown	via CMAUP database
E-senegasaponin a	71627223	Click to see CC1C(C(C(C(O1)OC(=O)C23CCC(CC2C4=CCC5C(C4(CC3)CO)(CCC6C5(CC(C(C6(C)C(=O)O)OC7C(C(C(C(O7)CO)O)O)O)O)C)C)(C)C)OC8C(C(C(C(O8)C)OC9C(C(C(CO9)OC1C(C(C(C(O1)CO)O)O)O)O)O)OC1C(C(CO1)(CO)O)O)O)O)OC(=O)C=CC1=CC=C(C=C1)OC	1559.60	unknown	via CMAUP database
E-senegasaponin b	70697808	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC(=O)C34CCC(CC3C5=CCC6C(C5(CC4)CO)(CCC7C6(CC(C(C7(C)C(=O)O)OC8C(C(C(C(O8)CO)O)O)O)O)C)C)(C)C)C)OC(=O)C=CC9=CC=C(C=C9)OC)O)O)O)OC1C(C(C(CO1)OC1C(C(C(C(O1)CO)O)O)O)O)O	1427.50	unknown	via CMAUP database
Onjisaponin A	21669941	Click to see CC1C(C(C(C(O1)OC2C(C(OC(C2OC3C(C(C(C(O3)C)OC4C(C(C(CO4)OC5C(C(C(C(O5)CO)O)O)O)O)O)OC6C(C(CO6)(CO)O)O)O)OC(=O)C78CCC(CC7C9=CCC1C(C9(CC8)CO)(CCC2C1(CC(C(C2(C)C(=O)O)OC1C(C(C(C(O1)CO)O)O)O)O)C)C)(C)C)C)OC(=O)C=CC1=CC=C(C=C1)OC)O)O)O	1705.80	unknown	via CMAUP database
Senegin II	11953920	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC(=O)C34CCC(CC3C5=CCC6C(C5(CC4)CO)(CCC7C6(CC(C(C7(C)C(=O)O)OC8C(C(C(C(O8)CO)O)O)O)O)C)C)(C)C)C)OC(=O)C=CC9=CC(=C(C=C9)OC)OC)O)O)O)OC1C(C(C(CO1)OC1C(C(C(C(O1)CO)O)O)O)O)O	1457.60	unknown	via CMAUP database
Senegin III	21669942	Click to see CC1C(C(C(C(O1)OC2C(C(OC(C2OC3C(C(C(C(O3)C)OC4C(C(C(CO4)OC5C(C(C(C(O5)CO)O)O)O)O)O)O)O)OC(=O)C67CCC(CC6C8=CCC9C(C8(CC7)CO)(CCC1C9(CC(C(C1(C)C(=O)O)OC1C(C(C(C(O1)CO)O)O)O)O)C)C)(C)C)C)OC(=O)C=CC1=CC=C(C=C1)OC)O)O)O	1573.70	unknown	via CMAUP database
Z-senegasaponin a	86289100	Click to see CC1C(C(C(C(O1)OC(=O)C23CCC(CC2C4=CCC5C(C4(CC3)CO)(CCC6C5(CC(C(C6(C)C(=O)O)OC7C(C(C(C(O7)CO)O)O)O)O)C)C)(C)C)OC8C(C(C(C(O8)C)OC9C(C(C(CO9)OC1C(C(C(C(O1)CO)O)O)O)O)O)OC1C(C(CO1)(CO)O)O)O)O)OC(=O)C=CC1=CC=C(C=C1)OC	1559.60	unknown	via CMAUP database
Z-senegasaponin b	70697802	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC(=O)C34CCC(CC3C5=CCC6C(C5(CC4)CO)(CCC7C6(CC(C(C7(C)C(=O)O)OC8C(C(C(C(O8)CO)O)O)O)O)C)C)(C)C)C)OC(=O)C=CC9=CC=C(C=C9)OC)O)O)O)OC1C(C(C(CO1)OC1C(C(C(C(O1)CO)O)O)O)O)O	1427.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones
[5-ethenyl-1-oxo-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-3-yl] (2E,6Z)-8-hydroxy-2,6-dimethylocta-2,6-dienoate	5317365	Click to see CC(=CCO)CCC=C(C)C(=O)OC1CC2C(C(OC=C2C(=O)O1)OC3C(C(C(C(O3)CO)O)O)O)C=C	540.60	unknown	via CMAUP database
7-{[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]oxy}-2H-chromen-2-one	5287282	Click to see CC(=CCCC(=CCCC(=CCOC1=CC2=C(C=C1)C=CC(=O)O2)C)C)C	366.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
(4aS,6aS,6aS,6bR,8aS,10S,12aR,14bR)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid	51892422	Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)O)C	456.70	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2007.03.029
1,4a,6a,6b,9,9,12a-Heptamethyl-10-oxo-1,2,3,4,5,6,6a,7,8,8a,11,12,13,14b-tetradecahydropicene-2-carboxylic acid	3640008	Click to see CC1C(CCC2(C1C3=CCC4C5(CCC(=O)C(C5CCC4(C3(CC2)C)C)(C)C)C)C)C(=O)O	454.70	unknown	https://doi.org/10.1248/CPB.43.868
3-Epioleanolic acid	11869658	Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)O)C	456.70	unknown	via CMAUP database
3-Hydroxyolean-12-en-28-oic acid	619166	Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)O)C	456.70	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2007.03.029
Oleanolic Acid	10494	Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)O)C	456.70	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2007.03.029 https://doi.org/10.1248/CPB.47.1448
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Ergostane steroids
(22E,24S)-5alpha,8alpha-epidioxy-24-methylcholesta-6,22-dien-3beta-ol	13830971	Click to see CC(C)C(C)C=CC(C)C1CCC2C1(CCC3C24C=CC5(C3(CCC(C5)O)C)OO4)C	428.60	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2007.03.029
5-(5,6-Dimethylhept-3-en-2-yl)-6,10-dimethyl-16,17-dioxapentacyclo[13.2.2.01,9.02,6.010,15]nonadec-18-en-13-ol	633877	Click to see CC(C)C(C)C=CC(C)C1CCC2C1(CCC3C24C=CC5(C3(CCC(C5)O)C)OO4)C	428.60	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2007.03.029
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Ergostane steroids / Ergosterols and derivatives
17-(5,6-dimethylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol	53461958	Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2C(C=C4C3(CCC(C4)O)C)O)C	416.70	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2007.03.029
7beta-Hydroxycampesterol	101112100	Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2C(C=C4C3(CCC(C4)O)C)O)C	416.70	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2007.03.029
Ergost-5-ene-3,7-diol	125143	Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2C(C=C4C3(CCC(C4)O)C)O)C	416.70	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2007.03.029
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Estrane steroids / Estrogens and derivatives
(13S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,16,17-triol	16757678	Click to see CC12CCC3C(C1CC(C2O)O)CCC4=C3C=CC(=C4)O	288.40	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Hydroxysteroids / 12-hydroxysteroids / 12-alpha-hydroxysteroids
Senegenic acid	12442765	Click to see CC1(CCC2(CCC3=C(C2C1)CCC4C3(CCC5C4(CC(C(C5(C)C(=O)O)O)O)C)C)C(=O)O)C	488.70	unknown	via CMAUP database
Senegenin	12442762	Click to see CC1(CCC2(CCC3=C(C2C1)C(CC4C3(CCC5C4(CC(C(C5(C)C(=O)O)O)O)C)C)CCl)C(=O)O)C	537.10	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
(3R,8R,9R,10S,13R,14R,17R)-17-[(E,2R,5R)-5-ethyl-6-methylhept-3-en-2-yl]-3,10,13-trimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene	50930798	Click to see CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)C)C)C)C(C)C	410.70	unknown	via CMAUP database
(5S)-17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol	16219965	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C)C(C)C	416.70	unknown	via CMAUP database
17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol	86821	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	414.70	unknown	https://doi.org/10.1248/CPB.47.1448
24-Ethylcholest-5-en-3beta-ol	22012	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	414.70	unknown	https://doi.org/10.1248/CPB.47.1448
beta-Sitosterol 3-O-beta-D-galactopyranoside	296119	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C	576.80	unknown	https://doi.org/10.1248/CPB.47.1448
Chondrillasterol	5283663	Click to see CCC(C=CC(C)C1CCC2C1(CCC3C2=CCC4C3(CCC(C4)O)C)C)C(C)C	412.70	unknown	via CMAUP database
Sitogluside	5742590	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C	576.80	unknown	https://doi.org/10.1248/CPB.47.1448
Stigmasterol	5280794	Click to see CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	412.70	unknown	https://doi.org/10.1248/CPB.47.1448 https://doi.org/10.1079/9781845934057.0227
Stigmasterol glucoside	6602508	Click to see CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C	574.80	unknown	https://doi.org/10.1248/CPB.47.1448
> Nucleosides, nucleotides, and analogues / Purine nucleosides
Adenosine	60961	Click to see C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)CO)O)O)N	267.24	unknown	https://doi.org/10.1248/CPB.47.988
> Nucleosides, nucleotides, and analogues / Purine nucleosides / Purine 2-deoxyribonucleosides
2'-Deoxyadenosine	13730	Click to see C1C(C(OC1N2C=NC3=C(N=CN=C32)N)CO)O	251.24	unknown	https://doi.org/10.1248/CPB.47.988
> Nucleosides, nucleotides, and analogues / Pyrimidine nucleosides
Uridine	6029	Click to see C1=CN(C(=O)NC1=O)C2C(C(C(O2)CO)O)O	244.20	unknown	https://doi.org/10.1248/CPB.47.988
> Nucleosides, nucleotides, and analogues / Pyrimidine nucleosides / Pyrimidine 2-deoxyribonucleosides
Thymidine	5789	Click to see CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O	242.23	unknown	https://doi.org/10.1248/CPB.47.988
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives
(1S,4R,5R,9R,11S,14R,15S,19R)-5,15-dihydroxy-1,11-bis(methylsulfanyl)-3,13-diazapentacyclo[11.7.0.03,11.04,9.014,19]icosa-6,16-diene-2,8,12,18-tetrone	163039822	Click to see CSC12CC3C(N1C(=O)C4(CC5C(N4C2=O)C(C=CC5=O)O)SC)C(C=CC3=O)O	450.50	unknown	https://doi.org/10.1248/CPB.44.337
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Glutamic acid and derivatives
CID 6037	6037	Click to see C1=CC(=CC=C1C(=O)NC(CCC(=O)O)C(=O)O)NCC2=CN=C3C(=N2)C(=O)N=C(N3)N	441.40	unknown	via CMAUP database
> Organic acids and derivatives / Hydroxy acids and derivatives / Medium-chain hydroxy acids and derivatives
(3R)-3-Hydroxydodecanoic acid	5312804	Click to see CCCCCCCCCC(CC(=O)O)O	216.32	unknown	via CMAUP database
(S)-3-hydroxylauric acid	5312805	Click to see CCCCCCCCCC(CC(=O)O)O	216.32	unknown	via CMAUP database
3-Hydroxydodecanoic acid	94216	Click to see CCCCCCCCCC(CC(=O)O)O	216.32	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6268697/
> Organic nitrogen compounds / Organonitrogen compounds / Amines / Primary amines / 2-arylethylamines
2-(4-Fluoro-1H-imidazol-5-yl)ethylamine	541569	Click to see C1=NC(=C(N1)CCN)F	129.14	unknown	via CMAUP database
> Organic nitrogen compounds / Organonitrogen compounds / Quaternary ammonium salts / Cholines
Choline	305	Click to see C[N+](C)(C)CCO	104.17	unknown	https://doi.org/10.1002/PTR.2650010211
> Organic oxygen compounds / Organic oxides
(S)-2,4-Dimethylpentanal	60140939	Click to see CC(C)CC(C)C=O	114.19	unknown	via CMAUP database
2,4-Dimethylpentanal	34072	Click to see CC(C)CC(C)C=O	114.19	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds
1-Methoxycyclohexene	70264	Click to see COC1=CCCCC1	112.17	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6268697/
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Quinic acids and derivatives
(1R,3S,4S,5S)-1,3,4-trihydroxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylic acid	15901362	Click to see COC1=C(C=CC(=C1)C=CC(=O)OC2CC(CC(C2O)O)(C(=O)O)O)O	368.30	unknown	via CMAUP database
(1S,3S,4R,5S)-3-[(Z)-3-(3,4-Dihydroxyphenyl)prop-2-enoyl]oxy-1-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-4,5-dihydroxycyclohexane-1-carboxylic acid	24720973	Click to see C1C(C(C(CC1(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O)O	516.40	unknown	via CMAUP database
1-Caffeoylquinic acid	10155076	Click to see C1C(C(C(CC1(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O)O	354.31	unknown	via CMAUP database
1,3-Dicaffeoylquinic acid	6474640	Click to see C1C(C(C(CC1(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O)O	516.40	unknown	via CMAUP database
1,4-Dicaffeoylquinic acid	12358846	Click to see C1C(C(C(CC1(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O	516.40	unknown	via CMAUP database
1,4-Dicaffeylquinic acid	5316647	Click to see C1C(C(C(CC1(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O	516.40	unknown	via CMAUP database
1,5-Dicaffeoyl quinic acid	13520496	Click to see C1C(C(C(CC1(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O)O	516.40	unknown	via CMAUP database
1,5-Dicaffeoylquinic acid	122685	Click to see C1C(C(C(CC1(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O)O	516.40	unknown	via CMAUP database
3-O-Feruloylquinic acid	9799386	Click to see COC1=C(C=CC(=C1)C=CC(=O)OC2CC(CC(C2O)O)(C(=O)O)O)O	368.30	unknown	via CMAUP database
4-O-feruloyl-D-quinic acid	10177048	Click to see COC1=C(C=CC(=C1)C=CC(=O)OC2C(CC(CC2O)(C(=O)O)O)O)O	368.30	unknown	via CMAUP database
Chlorogenic Acid	1794427	Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O	354.31	unknown	https://doi.org/10.1021/JF000171N
Chlorogensaure	12310830	Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O	354.31	unknown	via CMAUP database
Cinnamic acid, 3,4-dihydroxy-, (-)-1-carboxy-3,4,5-trihydroxycyclohexyl ester	6451212	Click to see C1C(C(C(CC1(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O)O	354.31	unknown	via CMAUP database
cis-Chlorogenic acid	1794425	Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O	354.31	unknown	via CMAUP database
Cryptochlorogenic acid	9798666	Click to see C1C(C(C(CC1(C(=O)O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O	354.31	unknown	via CMAUP database
Cynarine	5281769	Click to see C1C(C(C(CC1(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O)O	516.40	unknown	via CMAUP database
Neochlorogenic acid	5280633	Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O	354.31	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Polyols / 1,2-diols
1-Deoxy-D-xylitol	10796790	Click to see CC(C(C(CO)O)O)O	136.15	unknown	https://doi.org/10.1248/CPB.47.988
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Primary alcohols
(S)-(-)-2-Methyl-1-butanol	2723602	Click to see CCC(C)CO	88.15	unknown	https://doi.org/10.1248/CPB.46.1643
3-Methyl-2-buten-1-OL	11173	Click to see CC(=CCO)C	86.13	unknown	https://doi.org/10.1248/CPB.46.1643
Isoamyl alcohol	31260	Click to see CC(C)CCO	88.15	unknown	https://doi.org/10.1248/CPB.46.1643
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Secondary alcohols
(1S)-cyclohex-2-en-1-ol	5325854	Click to see C1CC=CC(C1)O	98.14	unknown	via CMAUP database
(R)-butane-1,3-diol	637497	Click to see CC(CCO)O	90.12	unknown	via CMAUP database
(S)-butane-1,3-diol	446973	Click to see CC(CCO)O	90.12	unknown	via CMAUP database
(Z)-hex-3-ene-2,5-diol	5356549	Click to see CC(C=CC(C)O)O	116.16	unknown	via CMAUP database
1-Deoxy-d-ribitol	270738	Click to see CC(C(C(CO)O)O)O	136.15	unknown	https://doi.org/10.1248/CPB.47.988
1-Deoxy-D-threitol	6398419	Click to see CC(C(CO)O)O	106.12	unknown	https://doi.org/10.1248/CPB.47.988
1,3-Butanediol	7896	Click to see CC(CCO)O	90.12	unknown	via CMAUP database
2-Cyclohexen-1-OL	13198	Click to see C1CC=CC(C1)O	98.14	unknown	via CMAUP database
2-Cyclohexen-1-ol, (1R)-	10486804	Click to see C1CC=CC(C1)O	98.14	unknown	via CMAUP database
2-Deoxy-D-erythro-pentitol	10796791	Click to see C(CO)C(C(CO)O)O	136.15	unknown	https://doi.org/10.1248/CPB.47.988
3-Hexene-2,5-diol	5363299	Click to see CC(C=CC(C)O)O	116.16	unknown	via CMAUP database
4-Methylbicyclo[3.1.1]hept-3-en-2-ol	130142498	Click to see CC1=CC(C2CC1C2)O	124.18	unknown	https://doi.org/10.1016/J.JPBA.2006.01.024
Dicyclopropylmethanol	84336	Click to see C1CC1C(C2CC2)O	112.17	unknown	https://doi.org/10.1016/J.JPBA.2006.01.024
Hex-3-ene-2,5-diol	246990	Click to see CC(C=CC(C)O)O	116.16	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Secondary alcohols / Cyclohexanols
(1S,3R)-3-methylcyclohexan-1-ol	229503	Click to see CC1CCCC(C1)O	114.19	unknown	via CMAUP database
(1S,3S)-3-methylcyclohexan-1-ol	642633	Click to see CC1CCCC(C1)O	114.19	unknown	via CMAUP database
3-Methylcyclohexanol	11566	Click to see CC1CCCC(C1)O	114.19	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6268697/
4-Ethylcyclohexanol	78293	Click to see CCC1CCC(CC1)O	128.21	unknown	via CMAUP database
cis-3-Methylcyclohexanol	21599	Click to see CC1CCCC(C1)O	114.19	unknown	via CMAUP database
trans-3-Methylcyclohexanol	641629	Click to see CC1CCCC(C1)O	114.19	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Tertiary alcohols
7-Octen-3-ol, 3,7-dimethyl-	557859	Click to see CCC(C)(CCCC(=C)C)O	156.26	unknown	via CMAUP database
Pinacol	6425	Click to see CC(C)(C(C)(C)O)O	118.17	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6268697/
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Aminosaccharides / Aminoglycosides
2-[(4S,5S,6R,7R,9R,10R,11Z,13E,15S,16R)-6-[(2S,3S,4R,5R,6R)-5-[(2S,4R,5R,6S)-4,5-dihydroxy-4,6-dimethyloxan-2-yl]oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-10-[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy-16-ethyl-4-hydroxy-5,9,13,15-tetramethyl-2-oxo-1-oxacyclohexadeca-11,13-dien-7-yl]acetaldehyde	163020191	Click to see CCC1C(C=C(C=CC(C(CC(C(C(C(CC(=O)O1)O)C)OC2C(C(C(C(O2)C)OC3CC(C(C(O3)C)O)(C)O)N(C)C)O)CC=O)C)OC4CCC(C(O4)C)N(C)C)C)C	869.10	unknown	https://doi.org/10.1248/CPB.44.337
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds
(1R,4S,6R)-1,3,3-Trimethyl-2-oxabicyclo[2.2.2]oct-6-yl beta-D-glucopyranoside	100917677	Click to see CC1(C2CCC(O1)(C(C2)OC3C(C(C(C(O3)CO)O)O)O)C)C	332.39	unknown	https://doi.org/10.1248/CPB.44.337
(1R,4S,6S,7R)-7-Hydroxy-1,3,3-trimethyl-2-oxabicyclo[2.2.2]oct-6-yl beta-D-glucopyranoside	10760131	Click to see CC1(C2CC(C(O1)(C(C2)OC3C(C(C(C(O3)CO)O)O)O)C)O)C	348.39	unknown	https://doi.org/10.1248/CPB.44.337
(1S,2S,4R)-1,8-Epoxy-p-menthan-2-ol glucoside	73815050	Click to see CC1(C2CCC(O1)(C(C2)OC3C(C(C(C(O3)CO)O)O)O)C)C	332.39	unknown	https://doi.org/10.1248/CPB.44.337
(1S,2S,4S)-1,8-Epoxy-p-menthane-2,7-diol 2-O-b-D-glucoside	85170188	Click to see CC1(C2CCC(O1)(C(C2)OC3C(C(C(C(O3)CO)O)O)O)CO)C	348.39	unknown	https://doi.org/10.1248/CPB.44.337
(1S,4S,6S,8R)-8-Hydroxy-1,3,3-trimethyl-2-oxabicyclo[2.2.2]oct-6-yl beta-D-glucopyranoside	10593828	Click to see CC1(C2CC(C(O1)(CC2O)C)OC3C(C(C(C(O3)CO)O)O)O)C	348.39	unknown	https://doi.org/10.1248/CPB.44.337
(1S,4S,6S)-1-(Hydroxymethyl)-3,3-dimethyl-2-oxabicyclo[2.2.2]oct-6-yl beta-D-glucopyranoside	10521670	Click to see CC1(C2CCC(O1)(C(C2)OC3C(C(C(C(O3)CO)O)O)O)CO)C	348.39	unknown	https://doi.org/10.1248/CPB.44.337
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[[(1R,4S,6S)-1,3,3-trimethyl-2-oxabicyclo[2.2.2]octan-6-yl]oxy]oxane-3,4,5-triol	10854025	Click to see CC1(C2CCC(O1)(C(C2)OC3C(C(C(C(O3)CO)O)O)O)C)C	332.39	unknown	https://doi.org/10.1248/CPB.44.337
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[[(1S,4R,6R,7S)-7-hydroxy-1,3,3-trimethyl-2-oxabicyclo[2.2.2]octan-6-yl]oxy]oxane-3,4,5-triol	10665390	Click to see CC1(C2CC(C(O1)(C(C2)OC3C(C(C(C(O3)CO)O)O)O)C)O)C	348.39	unknown	https://doi.org/10.1248/CPB.44.337
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[[(1S,4R,6R)-1,3,3-trimethyl-2-oxabicyclo[2.2.2]octan-6-yl]oxy]oxane-3,4,5-triol	21630950	Click to see CC1(C2CCC(O1)(C(C2)OC3C(C(C(C(O3)CO)O)O)O)C)C	332.39	unknown	https://doi.org/10.1248/CPB.44.337
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[[(1S,4R,6S)-1,3,3-trimethyl-2-oxabicyclo[2.2.2]octan-6-yl]oxy]oxane-3,4,5-triol	21630948	Click to see CC1(C2CCC(O1)(C(C2)OC3C(C(C(C(O3)CO)O)O)O)C)C	332.39	unknown	https://doi.org/10.1248/CPB.44.337
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[[(1S,4S,6R,8R)-8-hydroxy-1,3,3-trimethyl-2-oxabicyclo[2.2.2]octan-6-yl]oxy]oxane-3,4,5-triol	10783915	Click to see CC1(C2CC(C(O1)(CC2O)C)OC3C(C(C(C(O3)CO)O)O)O)C	348.39	unknown	https://doi.org/10.1248/CPB.44.337
2-(Hydroxymethyl)-6-phenylmethoxyoxane-3,4,5-triol	4984739	Click to see C1=CC=C(C=C1)COC2C(C(C(C(O2)CO)O)O)O	270.28	unknown	https://doi.org/10.1248/CPB.44.337
2-[[3,4-Dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-6-phenylmethoxyoxane-3,4,5-triol	14079044	Click to see C1C(C(C(O1)OCC2C(C(C(C(O2)OCC3=CC=CC=C3)O)O)O)O)(CO)O	402.40	unknown	https://doi.org/10.1248/CPB.44.337
2-Hydroxybenzyl beta-d-glucopyranoside	9943752	Click to see C1=CC=C(C(=C1)COC2C(C(C(C(O2)CO)O)O)O)O	286.28	unknown	https://doi.org/10.1248/CPB.44.337
2-phenylethyl beta-D-glucopyranoside	468284	Click to see C1=CC=C(C=C1)CCOC2C(C(C(C(O2)CO)O)O)O	284.30	unknown	https://doi.org/10.1248/CPB.44.337
4-Methoxybenzyl beta-D-glucopyranoside	10685601	Click to see COC1=CC=C(C=C1)COC2C(C(C(C(O2)CO)O)O)O	300.30	unknown	https://doi.org/10.1248/CPB.44.337
Benzyl b-sophoropyranoside	73157713	Click to see C1=CC=C(C=C1)COC2C(C(C(C(O2)CO)O)O)OC3C(C(C(C(O3)CO)O)O)O	432.40	unknown	https://doi.org/10.1248/CPB.44.337
Benzyl beta-d-glucopyranoside	188977	Click to see C1=CC=C(C=C1)COC2C(C(C(C(O2)CO)O)O)O	270.28	unknown	https://doi.org/10.1248/CPB.44.337
Benzyl-beta-d-glucopyranoside	13254166	Click to see C1=CC=C(C=C1)COC2C(C(C(C(O2)CO)O)O)O	270.28	unknown	https://doi.org/10.1248/CPB.46.1587
Foeniculoside IX	73657189	Click to see CC1(C2CC(C(O1)(CC2O)C)OC3C(C(C(C(O3)CO)O)O)O)C	348.39	unknown	https://doi.org/10.1248/CPB.44.337 https://doi.org/10.1248/CPB.46.1738
Foeniculoside VIII	73657192	Click to see CC1(C2CC(C(O1)(C(C2)OC3C(C(C(C(O3)CO)O)O)O)C)O)C	348.39	unknown	https://doi.org/10.1248/CPB.44.337 https://doi.org/10.1248/CPB.46.1738
Icariside F2	14079045	Click to see C1C(C(C(O1)OCC2C(C(C(C(O2)OCC3=CC=CC=C3)O)O)O)O)(CO)O	402.40	unknown	https://doi.org/10.1248/CPB.44.337
Isosalicin	12304407	Click to see C1=CC=C(C(=C1)COC2C(C(C(C(O2)CO)O)O)O)O	286.28	unknown	https://doi.org/10.1248/CPB.46.1587 https://doi.org/10.1248/CPB.44.337
Phenylethyl beta-D-glucopyranoside	11289099	Click to see C1=CC=C(C=C1)CCOC2C(C(C(C(O2)CO)O)O)O	284.30	unknown	https://doi.org/10.1248/CPB.44.337
Sucrose	5988	Click to see C(C1C(C(C(C(O1)OC2(C(C(C(O2)CO)O)O)CO)O)O)O)O	342.30	unknown	https://doi.org/10.1248/CPB.47.988
Zizybeoside I	11972301	Click to see C1=CC=C(C=C1)COC2C(C(C(C(O2)CO)O)O)OC3C(C(C(C(O3)CO)O)O)O	432.40	unknown	https://doi.org/10.1248/CPB.44.337 https://doi.org/10.1248/CPB.46.1587
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[4-[(2S)-2-hydroxypropyl]phenoxy]oxane-3,4,5-triol	163082766	Click to see CC(CC1=CC=C(C=C1)OC2C(C(C(C(O2)CO)O)O)O)O	314.33	unknown	https://doi.org/10.1248/CPB.44.337
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[4-[(E)-3-methoxyprop-1-enyl]phenoxy]oxane-3,4,5-triol	10758476	Click to see COCC=CC1=CC=C(C=C1)OC2C(C(C(C(O2)CO)O)O)O	326.34	unknown	https://doi.org/10.1248/CPB.44.337
(2S,3R,4S,5R,6S)-2-(hydroxymethyl)-6-[4-[(E)-3-hydroxyprop-1-enyl]-2,6-dimethoxyphenoxy]oxane-3,4,5-triol	154497544	Click to see COC1=CC(=CC(=C1OC2C(C(C(C(O2)CO)O)O)O)OC)C=CCO	372.40	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2007.03.029
1-(3-Hydroxy-4-Methoxyphenyl)-1,2-ethanediol 3'-O-b-D-glucoside	85207142	Click to see COC1=C(C=C(C=C1)C(CO)O)OC2C(C(C(C(O2)CO)O)O)O	346.33	unknown	https://doi.org/10.1248/CPB.44.337
2-(Hydroxymethyl)-6-[4-(2-hydroxypropyl)phenoxy]oxane-3,4,5-triol	85232549	Click to see CC(CC1=CC=C(C=C1)OC2C(C(C(C(O2)CO)O)O)O)O	314.33	unknown	https://doi.org/10.1248/CPB.44.337
2-(Hydroxymethyl)-6-[4-(3-hydroxyprop-1-enyl)-2,6-dimethoxyphenoxy]oxane-3,4,5-triol	323959	Click to see COC1=CC(=CC(=C1OC2C(C(C(C(O2)CO)O)O)O)OC)C=CCO	372.40	unknown	https://doi.org/10.1248/CPB.44.337 https://doi.org/10.1016/J.PHYTOCHEM.2007.03.029
2-(Hydroxymethyl)-6-[4-(3-methoxyprop-1-enyl)phenoxy]oxane-3,4,5-triol	85257886	Click to see COCC=CC1=CC=C(C=C1)OC2C(C(C(C(O2)CO)O)O)O	326.34	unknown	https://doi.org/10.1248/CPB.44.337
2-(Hydroxymethyl)-6-[4-(hydroxymethyl)-2,6-dimethoxyphenoxy]oxane-3,4,5-triol	13965334	Click to see COC1=CC(=CC(=C1OC2C(C(C(C(O2)CO)O)O)O)OC)CO	346.33	unknown	https://doi.org/10.1248/CPB.44.337
2-[2,6-Dimethoxy-4-(3-methoxyprop-1-enyl)phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol	163087111	Click to see COCC=CC1=CC(=C(C(=C1)OC)OC2C(C(C(C(O2)CO)O)O)O)OC	386.40	unknown	https://doi.org/10.1248/CPB.44.337
3-Hydroxy-2-methoxy-5-(2-propen-1-yl)phenyl beta-D-glucopyranoside	101702475	Click to see COC1=C(C=C(C=C1OC2C(C(C(C(O2)CO)O)O)O)CC=C)O	342.34	unknown	https://doi.org/10.1248/CPB.44.337
5-[(1R)-1,2-Dihydroxyethyl]-2-methoxyphenyl beta-D-glucopyranoside	10617551	Click to see COC1=C(C=C(C=C1)C(CO)O)OC2C(C(C(C(O2)CO)O)O)O	346.33	unknown	https://doi.org/10.1248/CPB.44.337
Cnidioside A	21592256	Click to see C1=COC2=CC(=C(C=C21)CCC(=O)O)OC3C(C(C(C(O3)CO)O)O)O	368.30	unknown	https://doi.org/10.1248/CPB.47.1448
Di-O-Methylcrenatin	10736338	Click to see COC1=CC(=CC(=C1OC2C(C(C(C(O2)CO)O)O)O)OC)CO	346.33	unknown	https://doi.org/10.1248/CPB.44.337
Eleutheroside B	5316860	Click to see COC1=CC(=CC(=C1OC2C(C(C(C(O2)CO)O)O)O)OC)C=CCO	372.40	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2007.03.029 https://doi.org/10.1248/CPB.46.1587 https://doi.org/10.1248/CPB.44.337
Methylsyringin	15108321	Click to see COCC=CC1=CC(=C(C(=C1)OC)OC2C(C(C(C(O2)CO)O)O)O)OC	386.40	unknown	https://doi.org/10.1248/CPB.44.337
Sphalleroside A	131751300	Click to see COC1=C(C=C(C=C1OC2C(C(C(C(O2)CO)O)O)O)CC=C)O	342.34	unknown	https://doi.org/10.1248/CPB.44.337
Syringin methyl ether	131752679	Click to see COCC=CC1=CC(=C(C(=C1)OC)OC2C(C(C(C(O2)CO)O)O)O)OC	386.40	unknown	https://doi.org/10.1248/CPB.46.1587
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Monosaccharides
(2R,3S,4S,5R)-2-(hydroxymethyl)oxane-3,4,5-triol	12905135	Click to see C1C(C(C(C(O1)CO)O)O)O	164.16	unknown	via CMAUP database
1,5-Anhydro-D-glucitol	64960	Click to see C1C(C(C(C(O1)CO)O)O)O	164.16	unknown	via CMAUP database
D-(-)-Fructose	5984	Click to see C(C(C(C(C(=O)CO)O)O)O)O	180.16	unknown	https://doi.org/10.1248/CPB.47.988
D-Fructose	2723872	Click to see C1C(C(C(C(O1)(CO)O)O)O)O	180.16	unknown	https://doi.org/10.1248/CPB.47.988
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Monosaccharides / Heptoses
D-manno-2-Heptulose	102926	Click to see C(C(C(C(C(C(=O)CO)O)O)O)O)O	210.18	unknown	via CMAUP database
D-Mannoheptulose	12600	Click to see C(C(C(C(C(C(=O)CO)O)O)O)O)O	210.18	unknown	https://doi.org/10.1016/J.JPBA.2006.01.024
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Monosaccharides / Hexoses
(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanal	107526	Click to see C(C(C(C(C(C=O)O)O)O)O)O	180.16	unknown	https://doi.org/10.1248/CPB.47.988
1-Deoxy-d-glucitol	10678630	Click to see CC(C(C(C(CO)O)O)O)O	166.17	unknown	https://doi.org/10.1248/CPB.47.988
D-Glucose	5793	Click to see C(C1C(C(C(C(O1)O)O)O)O)O	180.16	unknown	https://doi.org/10.1248/CPB.47.988
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Oligosaccharides
[(2S,3S,4R,5R)-2-[(2R,3R,4R,5R,6R)-6-(acetyloxymethyl)-4-[(2S,3R,4R,5S,6R)-6-(acetyloxymethyl)-3,4-dihydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxyoxan-2-yl]oxy-4-hydroxy-2-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxymethyl]-5-(hydroxymethyl)oxolan-3-yl] benzoate	10374132	Click to see CC(=O)OCC1C(C(C(C(O1)OC2C(C(OC(C2OC(=O)C=CC3=CC(=C(C=C3)O)OC)COC(=O)C)OC4(C(C(C(O4)CO)O)OC(=O)C5=CC=CC=C5)COC(=O)C=CC6=CC(=C(C=C6)O)OC)O)O)O)OC7C(C(C(C(O7)CO)O)O)O	1207.10	unknown	via CMAUP database
[(2S,3S,4R,5R)-2-[(2R,3R,4S,5R,6R)-4-[(2S,3R,4S,5S,6R)-6-(acetyloxymethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4-hydroxy-2-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxymethyl]-5-(hydroxymethyl)oxolan-3-yl] benzoate	10034247	Click to see CC(=O)OCC1C(C(C(C(O1)OC2C(C(OC(C2OC3C(C(C(C(O3)CO)O)O)O)OC4(C(C(C(O4)CO)O)OC(=O)C5=CC=CC=C5)COC(=O)C=CC6=CC(=C(C=C6)O)OC)CO)OC(=O)C=CC7=CC(=C(C=C7)O)OC)O)O)O	1165.10	unknown	via CMAUP database
[(2S,3S,4R,5R)-2-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-4-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4-hydroxy-5-(hydroxymethyl)-2-[[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxymethyl]oxolan-3-yl] benzoate	11818844	Click to see CC(=O)OCC1C(C(C(C(O1)OC2(C(C(C(O2)CO)O)OC(=O)C3=CC=CC=C3)COC(=O)C=CC4=CC=C(C=C4)O)OC5C(C(C(C(O5)CO)O)O)O)OC6C(C(C(C(O6)CO)OC7C(C(C(C(O7)CO)O)O)O)O)O)OC(=O)C=CC8=CC(=C(C=C8)O)OC	1297.20	unknown	via CMAUP database
[(2S,3S,4R,5R)-2-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-4-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4-hydroxy-2-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxymethyl]-5-(hydroxymethyl)oxolan-3-yl] benzoate	10351465	Click to see CC(=O)OCC1C(C(C(C(O1)OC2(C(C(C(O2)CO)O)OC(=O)C3=CC=CC=C3)COC(=O)C=CC4=CC(=C(C=C4)O)OC)OC5C(C(C(C(O5)CO)O)O)O)OC6C(C(C(C(O6)CO)OC7C(C(C(C(O7)CO)O)O)O)O)O)OC(=O)C=CC8=CC=C(C=C8)O	1297.20	unknown	via CMAUP database
[(2S,3S,4R,5R)-2-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-4-[(2S,3R,4R,5S,6R)-6-(acetyloxymethyl)-3,4-dihydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4-hydroxy-5-(hydroxymethyl)-2-[[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxymethyl]oxolan-3-yl] benzoate	10374233	Click to see CC(=O)OCC1C(C(C(C(O1)OC2C(C(OC(C2OC3C(C(C(C(O3)CO)O)O)O)OC4(C(C(C(O4)CO)O)OC(=O)C5=CC=CC=C5)COC(=O)C=CC6=CC=C(C=C6)O)COC(=O)C)OC(=O)C=CC7=CC(=C(C=C7)O)OC)O)O)OC8C(C(C(C(O8)CO)O)O)O	1339.20	unknown	via CMAUP database
[(2S,3S,4R,5R)-2-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-4-[(2S,3R,4R,5S,6R)-6-(acetyloxymethyl)-3,4-dihydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4-hydroxy-5-(hydroxymethyl)-2-[[(Z)-3-(4-hydroxyphenyl)prop-2-enoyl]oxymethyl]oxolan-3-yl] benzoate	10260886	Click to see CC(=O)OCC1C(C(C(C(O1)OC2C(C(OC(C2OC3C(C(C(C(O3)CO)O)O)O)OC4(C(C(C(O4)CO)O)OC(=O)C5=CC=CC=C5)COC(=O)C=CC6=CC=C(C=C6)O)COC(=O)C)OC(=O)C=CC7=CC(=C(C=C7)O)OC)O)O)OC8C(C(C(C(O8)CO)O)O)O	1339.20	unknown	via CMAUP database
[(2S,3S,4R,5R)-2-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-4-[(2S,3R,4R,5S,6R)-6-(acetyloxymethyl)-3,4-dihydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4-hydroxy-2-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxymethyl]-5-(hydroxymethyl)oxolan-3-yl] benzoate	10464150	Click to see CC(=O)OCC1C(C(C(C(O1)OC2C(C(OC(C2OC3C(C(C(C(O3)CO)O)O)O)OC4(C(C(C(O4)CO)O)OC(=O)C5=CC=CC=C5)COC(=O)C=CC6=CC(=C(C=C6)O)OC)COC(=O)C)OC(=O)C=CC7=CC=C(C=C7)O)O)O)OC8C(C(C(C(O8)CO)O)O)O	1339.20	unknown	via CMAUP database
[(2S,3S,4R,5R)-2-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-4-[(2S,3R,4R,5S,6R)-6-(acetyloxymethyl)-3,4-dihydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5-[(Z)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4-hydroxy-5-(hydroxymethyl)-2-[[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxymethyl]oxolan-3-yl] benzoate	10057265	Click to see CC(=O)OCC1C(C(C(C(O1)OC2C(C(OC(C2OC3C(C(C(C(O3)CO)O)O)O)OC4(C(C(C(O4)CO)O)OC(=O)C5=CC=CC=C5)COC(=O)C=CC6=CC=C(C=C6)O)COC(=O)C)OC(=O)C=CC7=CC(=C(C=C7)O)OC)O)O)OC8C(C(C(C(O8)CO)O)O)O	1339.20	unknown	via CMAUP database
[(2S,3S,4R,5R)-2-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-4-[(2S,3R,4S,5S,6R)-6-(acetyloxymethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4-hydroxy-2-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxymethyl]-5-(hydroxymethyl)oxolan-3-yl] benzoate	10351366	Click to see CC(=O)OCC1C(C(C(C(O1)OC2C(C(OC(C2OC3C(C(C(C(O3)CO)O)O)O)OC4(C(C(C(O4)CO)O)OC(=O)C5=CC=CC=C5)COC(=O)C=CC6=CC(=C(C=C6)O)OC)COC(=O)C)OC(=O)C=CC7=CC(=C(C=C7)O)OC)O)O)O	1207.10	unknown	via CMAUP database
[(2S,3S,4R,5R)-2-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy-3,4-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxan-2-yl]oxy-4-hydroxy-2-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxymethyl]-5-(hydroxymethyl)oxolan-3-yl] benzoate	10079963	Click to see CC(=O)OCC1C(C(C(C(O1)OC2(C(C(C(O2)CO)O)OC(=O)C3=CC=CC=C3)COC(=O)C=CC4=CC(=C(C=C4)O)OC)OC5C(C(C(C(O5)CO)O)O)O)OC6C(C(C(C(O6)CO)O)O)O)OC(=O)C=CC7=CC(=C(C=C7)O)OC	1165.10	unknown	via CMAUP database
Senegose A	44566678	Click to see CC(=O)OCC1C(C(C(C(O1)OC2C(C(OC(C2OC3C(C(C(C(O3)CO)O)O)O)OC4(C(C(C(O4)CO)O)OC(=O)C5=CC=CC=C5)COC(=O)C=CC6=CC(=C(C=C6)O)OC)COC(=O)C)OC(=O)C=CC7=CC(=C(C=C7)O)OC)O)O)OC8C(C(C(C(O8)CO)O)O)O	1369.20	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Sugar alcohols
D-Threitol	169019	Click to see C(C(C(CO)O)O)O	122.12	unknown	https://doi.org/10.1248/CPB.47.988
Erythritol	222285	Click to see C(C(C(CO)O)O)O	122.12	unknown	https://doi.org/10.1248/CPB.47.988
Glycerin	753	Click to see C(C(CO)O)O	92.09	unknown	https://doi.org/10.1248/CPB.47.988
Mannitol	6251	Click to see C(C(C(C(C(CO)O)O)O)O)O	182.17	unknown	https://doi.org/10.1248/CPB.47.988
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Alpha-hydrogen aldehydes
3-(Methylthio)propionaldehyde	18635	Click to see CSCCC=O	104.17	unknown	https://doi.org/10.1021/JF050340+
Isovaleraldehyde	11552	Click to see CC(C)CC=O	86.13	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Medium-chain aldehydes
(Z)-2-hexenal	6428782	Click to see CCCC=CC=O	98.14	unknown	via CMAUP database
2-Hexenal	5281168	Click to see CCCC=CC=O	98.14	unknown	via CMAUP database
2,4-Undecadienal	5367531	Click to see CCCCCCC=CC=CC=O	166.26	unknown	via CMAUP database
cis-3-Hexenal	643941	Click to see CCC=CCC=O	98.14	unknown	via CMAUP database
Hexanal	6184	Click to see CCCCCC=O	100.16	unknown	via CMAUP database
Undecanal	8186	Click to see CCCCCCCCCCC=O	170.29	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Alpha,beta-unsaturated aldehydes / Enals
2-Ethyl-2-butenal	29773	Click to see CCC(=CC)C=O	98.14	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6268697/
2-Ethylcrotonaldehyde	5362897	Click to see CCC(=CC)C=O	98.14	unknown	via CMAUP database
2-Methyl-2-pentenal	5319754	Click to see CCC=C(C)C=O	98.14	unknown	via CMAUP database
2-Methyl-pent-2-enal	12177	Click to see CCC=C(C)C=O	98.14	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6268697/
4,4-Dimethylpent-2-enal	5362894	Click to see CC(C)(C)C=CC=O	112.17	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Alpha,beta-unsaturated ketones
6,6,7-Trimethyl-3-octyne-2,5-dione	538570	Click to see CC(C)C(C)(C)C(=O)C#CC(=O)C	180.24	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Alpha,beta-unsaturated ketones / Enones
(Z)-3-hexen-2-one	6430723	Click to see CCC=CC(=O)C	98.14	unknown	via CMAUP database
1,2-Diacetylethylene	13177	Click to see CC(=O)C=CC(=O)C	112.13	unknown	via CMAUP database
3-Hexen-2-one	5367744	Click to see CCC=CC(=O)C	98.14	unknown	via CMAUP database
3-Hexene-2,5-dione	5363639	Click to see CC(=O)C=CC(=O)C	112.13	unknown	via CMAUP database
3,3,6-Trimethylhepta-1,5-dien-4-one	68346	Click to see CC(=CC(=O)C(C)(C)C=C)C	152.23	unknown	via CMAUP database
cis-3-Hexene-2,5-dione	5354485	Click to see CC(=O)C=CC(=O)C	112.13	unknown	via CMAUP database
Hexenone	12990	Click to see CCC=CC(=O)C	98.14	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6268697/
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Cyclic ketones
(R)-2-methoxycyclohexanone	6951549	Click to see COC1CCCCC1=O	128.17	unknown	via CMAUP database
(S)-2-Methoxycyclohexanone	642158	Click to see COC1CCCCC1=O	128.17	unknown	via CMAUP database
2-Methoxycyclohexanone	110998	Click to see COC1CCCCC1=O	128.17	unknown	https://doi.org/10.1016/J.JPBA.2006.01.024
3-Methyl-2-cyclopenten-1-one	17691	Click to see CC1=CC(=O)CC1	96.13	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6268697/
Cyclotene	6660	Click to see CC1=C(C(=O)CC1)O	112.13	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Cyclic ketones / Cyclohexenones
(R)-4-Isopropylcyclohex-2-enone	642520	Click to see CC(C)C1CCC(=O)C=C1	138.21	unknown	via CMAUP database
4-Isopropyl-2-cyclohexenone	92780	Click to see CC(C)C1CCC(=O)C=C1	138.21	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones
2-Heptanone	8051	Click to see CCCCCC(=O)C	114.19	unknown	via CMAUP database
3-Oxobutan-1-olate	53630514	Click to see [CH2+]C(=O)CC[O-]	86.09	unknown	via CMAUP database
Nonacosan-10-one	441490	Click to see CCCCCCCCCCCCCCCCCCCC(=O)CCCCCCCCC	422.80	unknown	https://doi.org/10.1016/S0305-1978(96)00106-8
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Phenylketones / Alkyl-phenylketones
3'-Methoxypropiophenone	584765	Click to see CCC(=O)C1=CC(=CC=C1)OC	164.20	unknown	https://doi.org/10.1016/J.JPBA.2006.01.024
4'-Methoxyacetophenone	7476	Click to see CC(=O)C1=CC=C(C=C1)OC	150.17	unknown	https://doi.org/10.1016/J.JPBA.2006.01.024
4'-Methoxypropiophenone	67144	Click to see CCC(=O)C1=CC=C(C=C1)OC	164.20	unknown	https://doi.org/10.1021/JF050340+
> Organic oxygen compounds / Organooxygen compounds / Enols
Hepta-1,3-dien-1-ol	73607705	Click to see CCCC=CC=CO	112.17	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6268697/
Tridecenol	20397979	Click to see CCCCCCCCCCCC=CO	198.34	unknown	https://doi.org/10.1089/JMF.2008.0327
> Organoheterocyclic compounds / Azoles / Imidazoles
2-(4-Fluoroimidazol-4-yl)ethanamine	68584299	Click to see C1=NC=NC1(CCN)F	129.14	unknown	https://doi.org/10.1016/J.JPBA.2006.01.024
> Organoheterocyclic compounds / Benzodioxoles
Apiole	10659	Click to see COC1=C2C(=C(C(=C1)CC=C)OC)OCO2	222.24	unknown	via CMAUP database
Dillapiol	10231	Click to see COC1=C(C2=C(C=C1CC=C)OCO2)OC	222.24	unknown	https://doi.org/10.1007/BF02976556 https://doi.org/10.1089/JMF.2008.0327
Myristicin	4276	Click to see COC1=CC(=CC2=C1OCO2)CC=C	192.21	unknown	via CMAUP database
> Organoheterocyclic compounds / Benzofurans / Benzofuranones
(3S)-5-hydroxy-3-[(3R)-3-hydroxybutyl]-3H-2-benzofuran-1-one	162975897	Click to see CC(CCC1C2=C(C=CC(=C2)O)C(=O)O1)O	222.24	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2007.03.029
(3S)-5-hydroxy-3-propyl-3H-2-benzofuran-1-one	163042664	Click to see CCCC1C2=C(C=CC(=C2)O)C(=O)O1	192.21	unknown	https://doi.org/10.1021/JF0713253
(3S)-5-methoxy-3-propyl-3H-2-benzofuran-1-one	162994615	Click to see CCCC1C2=C(C=CC(=C2)OC)C(=O)O1	206.24	unknown	https://doi.org/10.1021/JF0713253
5-hydroxy-3-propyl-3H-2-benzofuran-1-one	85745418	Click to see CCCC1C2=C(C=CC(=C2)O)C(=O)O1	192.21	unknown	https://doi.org/10.1021/JF0713253
5-methoxy-3-propyl-3H-2-benzofuran-1-one	85745415	Click to see CCCC1C2=C(C=CC(=C2)OC)C(=O)O1	206.24	unknown	https://doi.org/10.1021/JF0713253
> Organoheterocyclic compounds / Benzopyrans / 1-benzopyrans / Xanthones
Gentisin	5281636	Click to see COC1=CC(=C2C(=C1)OC3=C(C2=O)C=C(C=C3)O)O	258.23	unknown	via CMAUP database
> Organoheterocyclic compounds / Benzothiazoles
Benzothiazole	7222	Click to see C1=CC=C2C(=C1)N=CS2	135.19	unknown	via CMAUP database
> Organoheterocyclic compounds / Diazines / Pyrimidines and pyrimidine derivatives / Pyrimidones
Uracil	1174	Click to see C1=CNC(=O)NC1=O	112.09	unknown	https://doi.org/10.1248/CPB.47.988
> Organoheterocyclic compounds / Epoxides
1,2-Epoxyhexadecane	23741	Click to see CCCCCCCCCCCCCCC1CO1	240.42	unknown	https://doi.org/10.1016/J.JPBA.2006.01.024
> Organoheterocyclic compounds / Heteroaromatic compounds
Perillene	68316	Click to see CC(=CCCC1=COC=C1)C	150.22	unknown	via CMAUP database
> Organoheterocyclic compounds / Isobenzofurans
3-N-Butyl-4,5-dihydrophthalide	173843	Click to see CCCCC1C2=C(C=CCC2)C(=O)O1	192.25	unknown	via CMAUP database
Senkyunolide A	3085257	Click to see CCCCC1C2=C(C=CCC2)C(=O)O1	192.25	unknown	via CMAUP database
> Organoheterocyclic compounds / Lactones / Gamma butyrolactones
Dehydroascorbic acid	440667	Click to see C(C(C1C(=O)C(=O)C(=O)O1)O)O	174.11	unknown	via CMAUP database
> Organoheterocyclic compounds / Oxanes
(1S,2S,4S,5R)-1,8-Epoxy-p-menthane-2,5-diol	85195105	Click to see CC1(C2CC(C(O1)(CC2O)C)O)C	186.25	unknown	https://doi.org/10.1248/CPB.44.337
(1S,4S,5R,7R)-1,3,3-trimethyl-2-oxabicyclo[2.2.2]octane-5,7-diol	10797641	Click to see CC1(C2CC(C(O1)(CC2O)C)O)C	186.25	unknown	https://doi.org/10.1248/CPB.44.337
(1S,4S,5R,7S)-1,3,3-Trimethyl-2-oxabicyclo[2.2.2]octane-5,7-diol	10583714	Click to see CC1(C2CC(C(O1)(CC2O)C)O)C	186.25	unknown	https://doi.org/10.1248/CPB.44.337
Epomediol	115056	Click to see CC1(C2CC(C(O1)(C(C2)O)C)O)C	186.25	unknown	https://doi.org/10.1248/CPB.44.337
Eucalyptol	2758	Click to see CC1(C2CCC(O1)(CC2)C)C	154.25	unknown	via CMAUP database
> Organoheterocyclic compounds / Oxepanes
(-)-Kessane	91749835	Click to see CC1CCC2C1CC3CC2(OC3(C)C)C	208.34	unknown	via CMAUP database
(+)-trans-Limonene oxide	449290	Click to see CC(=C)C1CCC2(C(C1)O2)C	152.23	unknown	via CMAUP database
(1R,4R,6S)-1-methyl-4-(prop-1-en-2-yl)-7-oxabicyclo[4.1.0]heptane	6857487	Click to see CC(=C)C1CCC2(C(C1)O2)C	152.23	unknown	via CMAUP database
6-Methyl-3-propan-2-ylidene-7-oxabicyclo[4.1.0]heptan-2-one	61942	Click to see CC(=C1CCC2(C(C1=O)O2)C)C	166.22	unknown	https://doi.org/10.1080/10412905.1994.9698394
Kessane	11310616	Click to see CC1CCC2C1CC3CCC2(OC3(C)C)C	222.37	unknown	via CMAUP database
Limonene oxide, trans-(-)-	8029780	Click to see CC(=C)C1CCC2(C(C1)O2)C	152.23	unknown	via CMAUP database
Piperitenone oxide	442497	Click to see CC(=C1CCC2(C(C1=O)O2)C)C	166.22	unknown	https://doi.org/10.1016/S0305-1978(96)00106-8 https://doi.org/10.1080/10412905.1994.9698394
Piperitone oxide, (1S,2S,4S)-	6430796	Click to see CC(C)C1CCC2(C(C1=O)O2)C	168.23	unknown	via CMAUP database
trans-Limonen oxide	6429145	Click to see CC(C)C1CCC2(C(C1)O2)C	154.25	unknown	https://doi.org/10.1089/JMF.2008.0327
> Organoheterocyclic compounds / Pteridines and derivatives / Pterins and derivatives / Folic acids and derivatives / Folic acids
2-[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid	3405	Click to see C1=CC(=CC=C1C(=O)NC(CCC(=O)O)C(=O)O)NCC2=CN=C3C(=N2)C(=O)N=C(N3)N	441.40	unknown	via CMAUP database
> Phenylpropanoids and polyketides / 2-arylbenzofuran flavonoids
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[3-hydroxy-5-[(2R,3S)-6-hydroxy-4-[(2R,3R)-6-hydroxy-2-(4-hydroxyphenyl)-4-[(Z)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-3-yl]-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-3-yl]phenoxy]oxan-2-yl]methoxy]oxane-3,4,5-triol	162831676	Click to see C1=CC(=CC=C1C=CC2=C3C(C(OC3=CC(=C2)O)C4=CC=C(C=C4)O)C5=C6C(C(OC6=CC(=C5)O)C7=CC=C(C=C7)O)C8=CC(=CC(=C8)OC9C(C(C(C(O9)COC1C(C(C(C(O1)CO)O)O)O)O)O)O)O)O	1005.00	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2007.03.029
(2S,3R,4S,5S,6R)-2-[[(2R,3R)-3-(3,5-dihydroxyphenyl)-4-[(2S,3S)-6-hydroxy-2-(4-hydroxyphenyl)-4-[(Z)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-3-yl]-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-6-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol	10010748	Click to see C1=CC(=CC=C1C=CC2=C3C(C(OC3=CC(=C2)O)C4=CC=C(C=C4)O)C5=C6C(C(OC6=CC(=C5)OC7C(C(C(C(O7)CO)O)O)O)C8=CC=C(C=C8)O)C9=CC(=CC(=C9)O)O)O	842.80	unknown	https://doi.org/10.1248/CPB.43.868
(2S,3R,4S,5S,6R)-2-[3-hydroxy-5-[(2R,3R)-2-(4-hydroxyphenyl)-4-[(2S,3S)-2-(4-hydroxyphenyl)-4-[(Z)-2-(4-hydroxyphenyl)ethenyl]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydro-1-benzofuran-3-yl]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydro-1-benzofuran-3-yl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol	10374085	Click to see C1=CC(=CC=C1C=CC2=C3C(C(OC3=CC(=C2)OC4C(C(C(C(O4)CO)O)O)O)C5=CC=C(C=C5)O)C6=C7C(C(OC7=CC(=C6)OC8C(C(C(C(O8)CO)O)O)O)C9=CC=C(C=C9)O)C1=CC(=CC(=C1)OC1C(C(C(C(O1)CO)O)O)O)O)O	1167.10	unknown	https://doi.org/10.1248/CPB.43.868
(2S,3R,4S,5S,6R)-2-[3-hydroxy-5-[(2R,3R)-4-[(2S,3S)-6-hydroxy-2-(4-hydroxyphenyl)-4-[(Z)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-3-yl]-2-(4-hydroxyphenyl)-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydro-1-benzofuran-3-yl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol	10441022	Click to see C1=CC(=CC=C1C=CC2=C3C(C(OC3=CC(=C2)O)C4=CC=C(C=C4)O)C5=C6C(C(OC6=CC(=C5)OC7C(C(C(C(O7)CO)O)O)O)C8=CC=C(C=C8)O)C9=CC(=CC(=C9)OC1C(C(C(C(O1)CO)O)O)O)O)O	1005.00	unknown	https://doi.org/10.1248/CPB.43.868
(2S,3R,4S,5S,6R)-2-[3-hydroxy-5-[(2R,3R)-6-hydroxy-4-[(2S,3S)-6-hydroxy-2-(4-hydroxyphenyl)-4-[(Z)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-3-yl]-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-3-yl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol	9988103	Click to see C1=CC(=CC=C1C=CC2=C3C(C(OC3=CC(=C2)O)C4=CC=C(C=C4)O)C5=C6C(C(OC6=CC(=C5)O)C7=CC=C(C=C7)O)C8=CC(=CC(=C8)OC9C(C(C(C(O9)CO)O)O)O)O)O	842.80	unknown	https://doi.org/10.1248/CPB.43.868
(2S,3R,4S,5S,6R)-2-[3-hydroxy-5-[(2S,3R)-6-hydroxy-2-(4-hydroxyphenyl)-4-[(2R,3R)-2-(4-hydroxyphenyl)-4-[(Z)-2-(4-hydroxyphenyl)ethenyl]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydro-1-benzofuran-3-yl]-2,3-dihydro-1-benzofuran-3-yl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol	154496577	Click to see C1=CC(=CC=C1C=CC2=C3C(C(OC3=CC(=C2)OC4C(C(C(C(O4)CO)O)O)O)C5=CC=C(C=C5)O)C6=C7C(C(OC7=CC(=C6)O)C8=CC=C(C=C8)O)C9=CC(=CC(=C9)OC1C(C(C(C(O1)CO)O)O)O)O)O	1005.00	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2007.03.029
2-[3-hydroxy-5-[4-[6-hydroxy-2-(4-hydroxyphenyl)-4-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-3-yl]-2-(4-hydroxyphenyl)-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydro-1-benzofuran-3-yl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol	131753167	Click to see C1=CC(=CC=C1C=CC2=C3C(C(OC3=CC(=C2)O)C4=CC=C(C=C4)O)C5=C6C(C(OC6=CC(=C5)OC7C(C(C(C(O7)CO)O)O)O)C8=CC=C(C=C8)O)C9=CC(=CC(=C9)OC1C(C(C(C(O1)CO)O)O)O)O)O	1005.00	unknown	https://doi.org/10.1248/CPB.43.868
2-[3-Hydroxy-5-[6-hydroxy-4-[6-hydroxy-2-(4-hydroxyphenyl)-4-[2-(4-hydroxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-3-yl]-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-3-yl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol	85084613	Click to see C1=CC(=CC=C1C=CC2=C3C(C(OC3=CC(=C2)O)C4=CC=C(C=C4)O)C5=C6C(C(OC6=CC(=C5)O)C7=CC=C(C=C7)O)C8=CC(=CC(=C8)OC9C(C(C(C(O9)CO)O)O)O)O)O	842.80	unknown	https://doi.org/10.1248/CPB.43.868
5-[(2S,3R)-6-hydroxy-4-[(2R,3S)-6-hydroxy-2-(4-hydroxyphenyl)-4-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-3-yl]-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-3-yl]benzene-1,3-diol	160649591	Click to see C1=CC(=CC=C1C=CC2=C3C(C(OC3=CC(=C2)O)C4=CC=C(C=C4)O)C5=C6C(C(OC6=CC(=C5)O)C7=CC=C(C=C7)O)C8=CC(=CC(=C8)O)O)O	680.70	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2007.03.029
5-[6-Hydroxy-4-[6-hydroxy-2-(4-hydroxyphenyl)-4-[2-(4-hydroxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-3-yl]-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-3-yl]benzene-1,3-diol	366355	Click to see C1=CC(=CC=C1C=CC2=C3C(C(OC3=CC(=C2)O)C4=CC=C(C=C4)O)C5=C6C(C(OC6=CC(=C5)O)C7=CC=C(C=C7)O)C8=CC(=CC(=C8)O)O)O	680.70	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2007.03.029 https://doi.org/10.1248/CPB.43.868
beta-D-Glucopyranoside, (2S,2'R,3S,3'R)-3'-(3,5-dihydroxyphenyl)-2,2',3,3'-tetrahydro-6-hydroxy-2,2'-bis(4-hydroxyphenyl)-4-[(1Z)-2-(4-hydroxyphenyl)ethenyl][3,4'-bibenzofuran]-6'-yl	85091809	Click to see C1=CC(=CC=C1C=CC2=C3C(C(OC3=CC(=C2)O)C4=CC=C(C=C4)O)C5=C6C(C(OC6=CC(=C5)OC7C(C(C(C(O7)CO)O)O)O)C8=CC=C(C=C8)O)C9=CC(=CC(=C9)O)O)O	842.80	unknown	https://doi.org/10.1248/CPB.43.868
beta-D-Glucopyranoside, (2S,2'R,3S,3'R)-3'-[3-(beta-D-glucopyranosyloxy)-5-hydroxyphenyl]-2,2',3,3'-tetrahydro-2,2'-bis(4-hydroxyphenyl)-4-[(1Z)-2-(4-hydroxyphenyl)ethenyl][3,4'-bibenzofuran]-6,6'-diyl bis-	85125539	Click to see C1=CC(=CC=C1C=CC2=C3C(C(OC3=CC(=C2)OC4C(C(C(C(O4)CO)O)O)O)C5=CC=C(C=C5)O)C6=C7C(C(OC7=CC(=C6)OC8C(C(C(C(O8)CO)O)O)O)C9=CC=C(C=C9)O)C1=CC(=CC(=C1)OC1C(C(C(C(O1)CO)O)O)O)O)O	1167.10	unknown	https://doi.org/10.1248/CPB.43.868
beta-D-Glucopyranoside, (2S,2'R,3S,3'R)-3'-[3-(beta-D-glucopyranosyloxy)-5-hydroxyphenyl]-2,2',3,3'-tetrahydro-6-hydroxy-2,2'-bis(4-hydroxyphenyl)-4-[(1Z)-2-(4-hydroxyphenyl)ethenyl][3,4'-bibenzofuran]-6'-yl	85144230	Click to see C1=CC(=CC=C1C=CC2=C3C(C(OC3=CC(=C2)O)C4=CC=C(C=C4)O)C5=C6C(C(OC6=CC(=C5)OC7C(C(C(C(O7)CO)O)O)O)C8=CC=C(C=C8)O)C9=CC(=CC(=C9)OC1C(C(C(C(O1)CO)O)O)O)O)O	1005.00	unknown	https://doi.org/10.1248/CPB.43.868
cis-Miyabenol C	14412022	Click to see C1=CC(=CC=C1C=CC2=C3C(C(OC3=CC(=C2)O)C4=CC=C(C=C4)O)C5=C6C(C(OC6=CC(=C5)O)C7=CC=C(C=C7)O)C8=CC(=CC(=C8)O)O)O	680.70	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2007.03.029 https://doi.org/10.1248/CPB.43.868
Foeniculoside IV	131752778	Click to see C1=CC(=CC=C1C=CC2=C3C(C(OC3=CC(=C2)OC4C(C(C(C(O4)CO)O)O)O)C5=CC=C(C=C5)O)C6=C7C(C(OC7=CC(=C6)OC8C(C(C(C(O8)CO)O)O)O)C9=CC=C(C=C9)O)C1=CC(=CC(=C1)OC1C(C(C(C(O1)CO)O)O)O)O)O	1167.10	unknown	https://doi.org/10.1248/CPB.43.868
Miyabenol C	5388319	Click to see C1=CC(=CC=C1C=CC2=C3C(C(OC3=CC(=C2)O)C4=CC=C(C=C4)O)C5=C6C(C(OC6=CC(=C5)O)C7=CC=C(C=C7)O)C8=CC(=CC(=C8)O)O)O	680.70	unknown	https://doi.org/10.1248/CPB.43.868
trans-miyabenol C	6475924	Click to see C1=CC(=CC=C1C=CC2=C3C(C(OC3=CC(=C2)O)C4=CC=C(C=C4)O)C5=C6C(C(OC6=CC(=C5)O)C7=CC=C(C=C7)O)C8=CC(=CC(=C8)O)O)O	680.70	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2007.03.029 https://doi.org/10.1248/CPB.43.868
> Phenylpropanoids and polyketides / Cinnamaldehydes
Dillapional	5458880	Click to see COC1=C(C2=C(C=C1C=CC=O)OCO2)OC	236.22	unknown	https://doi.org/10.1007/BF02976556
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Cinnamic acids
4-Coumarate	54708745	Click to see C1=CC(=CC=C1C=CC(=O)O)[O-]	163.15	unknown	via CMAUP database
Cinnamic acid	444539	Click to see C1=CC=C(C=C1)C=CC(=O)O	148.16	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives
(S)-rosmarinic acid	639655	Click to see C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O	360.30	unknown	via CMAUP database
Rosmarinate	5315615	Click to see C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O	360.30	unknown	via CMAUP database
Rosmarinic acid	5281792	Click to see C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O	360.30	unknown	via CMAUP database
Sinapine	5280385	Click to see C[N+](C)(C)CCOC(=O)C=CC1=CC(=C(C(=C1)OC)O)OC	310.36	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids
(E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid	2518	Click to see C1=CC(=C(C=C1C=CC(=O)O)O)O	180.16	unknown	https://doi.org/10.1021/JF0713253
2-Hydroxycinnamic acid, (2E)-	637540	Click to see C1=CC=C(C(=C1)C=CC(=O)O)O	164.16	unknown	via CMAUP database
Caffeic Acid	689043	Click to see C1=CC(=C(C=C1C=CC(=O)O)O)O	180.16	unknown	https://doi.org/10.1021/JF0713253
Ferulic acid	445858	Click to see COC1=C(C=CC(=C1)C=CC(=O)O)O	194.18	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Cinnamyl alcohols
1-Dideuterio-3-phenylprop-2-en-1-ol	10534709	Click to see C1=CC=C(C=C1)C=CCO	136.19	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Coumarins and derivatives / Coumarin glycosides
Esculin	5281417	Click to see C1=CC(=O)OC2=CC(=C(C=C21)OC3C(C(C(C(O3)CO)O)O)O)O	340.28	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Coumarins and derivatives / Furanocoumarins / Psoralens
Pentosalen	10212	Click to see CC(=CCOC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2)C	270.28	unknown	https://doi.org/10.1007/BF02976556 https://doi.org/10.1211/0022357991777218
Psoralen	6199	Click to see C1=CC(=O)OC2=CC3=C(C=CO3)C=C21	186.16	unknown	https://doi.org/10.1007/BF02976556 https://doi.org/10.1016/S0031-9422(00)81503-4
> Phenylpropanoids and polyketides / Coumarins and derivatives / Furanocoumarins / Psoralens / 5-methoxypsoralens
Bergapten	2355	Click to see COC1=C2C=CC(=O)OC2=CC3=C1C=CO3	216.19	unknown	https://doi.org/10.1007/BF02976556 https://doi.org/10.1211/0022357991777218 https://doi.org/10.1021/JF0713253
> Phenylpropanoids and polyketides / Coumarins and derivatives / Furanocoumarins / Psoralens / 8-hydroxypsoralens
Xanthotoxol	65090	Click to see C1=CC(=O)OC2=C(C3=C(C=CO3)C=C21)O	202.16	unknown	https://doi.org/10.1211/0022357991777218
> Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins / 7-hydroxycoumarins
3,4,5,6,8-Pentadeuterio-7-hydroxychromen-2-one	45358955	Click to see C1=CC(=CC2=C1C=CC(=O)O2)O	167.17	unknown	via CMAUP database
Scopoletin	5280460	Click to see COC1=C(C=C2C(=C1)C=CC(=O)O2)O	192.17	unknown	https://doi.org/10.1007/BF02976556
Umbelliferone	5281426	Click to see C1=CC(=CC2=C1C=CC(=O)O2)O	162.14	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Coumarins and derivatives / Pyranocoumarins / Angular pyranocoumarins
Seselin	68229	Click to see CC1(C=CC2=C(O1)C=CC3=C2OC(=O)C=C3)C	228.24	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Diarylheptanoids / Cyclic diarylheptanoids / Meta,meta-bridged biphenyls
(7R)-3,7-dihydroxy-15,16,17-trimethoxytricyclo[12.3.1.12,6]nonadeca-1(17),2,4,6(19),14(18),15-hexaen-9-one	163189539	Click to see COC1=C(C(=C2C=C1CCCCC(=O)CC(C3=CC2=C(C=C3)O)O)OC)OC	386.40	unknown	https://doi.org/10.1248/CPB.44.337
> Phenylpropanoids and polyketides / Flavonoids / Biflavonoids and polyflavonoids
5,7-Dihydroxy-8-[2-hydroxy-5-(7-methoxy-4-oxochromen-2-yl)phenyl]-2-(4-hydroxyphenyl)chromen-4-one	5321275	Click to see COC1=CC2=C(C=C1)C(=O)C=C(O2)C3=CC(=C(C=C3)O)C4=C(C=C(C5=C4OC(=CC5=O)C6=CC=C(C=C6)O)O)O	536.50	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Flavanones
(2R)-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one	667495	Click to see C1C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC=C(C=C3)O	272.25	unknown	via CMAUP database
5,7-Dihydroxy-2-(4-hydroxyphenyl)chroman-4-one	932	Click to see C1C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC=C(C=C3)O	272.25	unknown	via CMAUP database
Naringenin	439246	Click to see C1C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC=C(C=C3)O	272.25	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavones
Apigenin	5280443	Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O	270.24	unknown	https://doi.org/10.1016/S0308-8146(00)00091-1
Luteolin	5280445	Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O)O	286.24	unknown	https://doi.org/10.1016/S0308-8146(00)00091-1
> Phenylpropanoids and polyketides / Flavonoids / Flavones / Flavonols
Isorhamnetin	5281654	Click to see COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O	316.26	unknown	via CMAUP database
Kaempferol	5280863	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O	286.24	unknown	via CMAUP database
Myricetin	5281672	Click to see C1=C(C=C(C(=C1O)O)O)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O	318.23	unknown	https://doi.org/10.1016/S0308-8146(00)00091-1
Quercetin	5280343	Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O	302.23	unknown	https://doi.org/10.1211/0022357991777218 https://doi.org/10.1016/S0308-8146(00)00091-1
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glucuronides / Flavonoid-3-O-glucuronides
(2S,3S,6S)-6-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid	44259219	Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)C(=O)O)O)O)O)O)O	478.40	unknown	https://doi.org/10.3390/70200245 https://doi.org/10.1021/JF000171N
(2S,3S,6S)-6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid	44258914	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)C(=O)O)O)O)O)O	462.40	unknown	via CMAUP database
Kaempferol 3-glucuronide	5318759	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)C(=O)O)O)O)O)O	462.40	unknown	via CMAUP database
Kaempferol-3-glucuronide	22846027	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)C(=O)O)O)O)O)O	462.40	unknown	via CMAUP database
Miquelianin (Quercetin 3-O-glucuronide)	13258914	Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)C(=O)O)O)O)O)O)O	478.40	unknown	via CMAUP database
Nelumboside	11968794	Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)C(=O)O)OC5C(C(C(C(O5)CO)O)O)O)O)O)O)O	640.50	unknown	via CMAUP database
Quercetin 3-glucuronide	12004528	Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)C(=O)O)O)O)O)O)O	478.40	unknown	https://doi.org/10.3390/70200245
Querciturone	5274585	Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)C(=O)O)O)O)O)O)O	478.40	unknown	https://doi.org/10.3390/70200245
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glucuronides / Flavonoid-7-O-glucuronides
(2S,3S,4S,5R,6S)-3,5-dihydroxy-6-[6-hydroxy-2-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxy-4-methyloxane-2-carboxylic acid	92131275	Click to see CC1C(C(OC(C1O)OC2=C(C=C3C(=C2)OC(=CC3=O)C4=CC=C(C=C4)O)O)C(=O)O)O	444.40	unknown	via CMAUP database
Luteolin 7-glucuronide	5280601	Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)C(=O)O)O)O)O)O)O)O	462.40	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides
[2-[5,7-Dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-5-hydroxy-3-[3-(4-hydroxyphenyl)prop-2-enoyloxy]-6-methyloxan-4-yl] 3-(4-hydroxyphenyl)prop-2-enoate	74978082	Click to see CC1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC=C(C=C4)O)OC(=O)C=CC5=CC=C(C=C5)O)OC(=O)C=CC6=CC=C(C=C6)O)O	724.70	unknown	https://doi.org/10.3390/70200245
2-(3,4-Dihydroxy-phenyl)-5,7-dihydroxy-3-(3,4,5-trihydroxy-6-methyl-tetrahydro-pyran-2-yloxy)-chromen-4-one	5353915	Click to see CC1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C=C4)O)O)O)O)O	448.40	unknown	https://doi.org/10.3390/70200245
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2R,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxychromen-4-one	5317847	Click to see C1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C=C4)O)O)O)O)O	434.30	unknown	via CMAUP database
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one	51402807	Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O	464.40	unknown	https://doi.org/10.3390/70200245
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one	5378597	Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O	464.40	unknown	https://doi.org/10.3390/70200245
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,5S)-3,4,5-trihydroxyoxan-2-yl]oxychromen-4-one	44259215	Click to see C1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C=C4)O)O)O)O)O	434.30	unknown	https://doi.org/10.1016/S0021-9673(01)97853-7
4H-1-Benzopyran-4-one, 3-(alpha-L-arabinofuranosyloxy)-5,7-dihydroxy-2-(4-hydroxyphenyl)-	5748554	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(O4)CO)O)O)O	418.30	unknown	via CMAUP database
5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-[(2S,4R,5S)-3,4,5-trihydroxy-6-[[(2R,4R,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one	45933931	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)OC)O)O)O)O)O)O	624.50	unknown	via CMAUP database
5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-[(3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one	71463991	Click to see COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O	478.40	unknown	via CMAUP database
5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-4H-chromen-3-yl 6-O-(6-deoxy-alpha-D-mannopyranosyl)-beta-D-glucopyranoside	17751019	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)OC)O)O)O)O)O)O	624.50	unknown	via CMAUP database
5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one	20055286	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O)O)O	594.50	unknown	via CMAUP database
5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2S,4R,5S)-3,4,5-trihydroxy-6-[[(2R,4R,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one	24211973	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O)O)O	594.50	unknown	via CMAUP database
5,7-Dihydroxy-2-(4-hydroxyphenyl)-3-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxychromen-4-one	12313332	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O)O)O	594.50	unknown	via CMAUP database
Afzelin	5316673	Click to see CC1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC=C(C=C4)O)O)O)O	432.40	unknown	https://doi.org/10.3390/70200245
Astragalin	5282102	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O	448.40	unknown	via CMAUP database
Avicularin	5490064	Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(O4)CO)O)O)O)O	434.30	unknown	https://doi.org/10.1016/S0031-9422(00)94055-X
Guaijaverin	5481224	Click to see C1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C=C4)O)O)O)O)O	434.30	unknown	https://doi.org/10.1016/S0021-9673(01)97853-7 https://doi.org/10.1248/YAKUSHI1947.79.7_986
Hyperasid	90657624	Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)[O-]	463.40	unknown	via CMAUP database
Hyperoside	5281643	Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O	464.40	unknown	via CMAUP database
Isoquercetin	5280804	Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O	464.40	unknown	https://doi.org/10.3390/70200245
Isorhamnetin 3-galactoside	13245586	Click to see COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O	478.40	unknown	https://doi.org/10.3390/70200245
isorhamnetin 3-O-glucoside	5318645	Click to see COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O	478.40	unknown	https://doi.org/10.3390/70200245
Kaempferol 3-O-arabinoside	5481882	Click to see C1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC=C(C=C4)O)O)O)O	418.30	unknown	via CMAUP database
Kaempferol-3-O-rhamnoside	5835713	Click to see CC1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC=C(C=C4)O)O)O)O	432.40	unknown	https://doi.org/10.3390/70200245
Kaempferol-3-O-rutinoside	5318767	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O)O)O	594.50	unknown	via CMAUP database
Narcissin	5481663	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)OC)O)O)O)O)O)O	624.50	unknown	via CMAUP database
Platanoside	6451113	Click to see CC1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC=C(C=C4)O)OC(=O)C=CC5=CC=C(C=C5)O)OC(=O)C=CC6=CC=C(C=C6)O)O	724.70	unknown	https://doi.org/10.3390/70200245
Quercitrin	5280459	Click to see CC1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C=C4)O)O)O)O)O	448.40	unknown	https://doi.org/10.3390/70200245
Reynoutrin	5878729	Click to see C1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C=C4)O)O)O)O)O	434.30	unknown	https://doi.org/10.1248/YAKUSHI1947.79.7_986
Rutin	5280805	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O	610.50	unknown	https://doi.org/10.3390/70200245
Vitamin P	5293655	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O	610.50	unknown	https://doi.org/10.3390/70200245
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-7-O-glycosides
2-(3,4-dihydroxyphenyl)-5-hydroxy-7-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2,3-dihydrochromen-4-one	53486247	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O)O	596.50	unknown	via CMAUP database
2-(3,4-Dihydroxyphenyl)-5-hydroxy-7-[(2S,4R,5S)-3,4,5-trihydroxy-6-[[(2R,4R,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2,3-dihydrochromen-4-one	24211951	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O)O	596.50	unknown	via CMAUP database
2-(3,4-dihydroxyphenyl)-5-hydroxy-7-[(2S,4S,5S)-3,4,5-trihydroxy-6-[[(2R,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2,3-dihydrochromen-4-one	42607972	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O)O	596.50	unknown	via CMAUP database
2-(3,4-Dihydroxyphenyl)-5-hydroxy-7-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxy-2,3-dihydrochromen-4-one	3564542	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O)O	596.50	unknown	via CMAUP database
CID 13872461	13872461	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O)O	596.50	unknown	via CMAUP database
Eriocitrin	83489	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O)O	596.50	unknown	via CMAUP database
Linarin	5317025	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=CC(=C4C(=C3)OC(=CC4=O)C5=CC=C(C=C5)OC)O)O)O)O)O)O)O	592.50	unknown	via CMAUP database
Narirutin	442431	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)O)O)O)O)O)O	580.50	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 4-O-methylated flavonoids
Acacetin	5280442	Click to see COC1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O	284.26	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Stilbenes / Stilbene glycosides
2-[3-Hydroxy-5-[2-(4-hydroxyphenyl)vinyl]phenoxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol	393787	Click to see C1=CC(=CC=C1C=CC2=CC(=CC(=C2)OC3C(C(C(C(O3)CO)O)O)O)O)O	390.40	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2007.03.029
Piceid	5281718	Click to see C1=CC(=CC=C1C=CC2=CC(=CC(=C2)OC3C(C(C(C(O3)CO)O)O)O)O)O	390.40	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2007.03.029
> Phenylpropanoids and polyketides / Tannins / Hydrolyzable tannins
Glucosyringic acid	10383888	Click to see COC1=CC(=CC(=C1OC2C(C(C(C(O2)CO)O)O)O)OC)C(=O)O	360.31	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2007.03.029

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Foeniculum vulgare

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