Scientific name	Authority	First published in
Limon vulgare	Mill.	Gard. Dict. ed. 8 : n.º 1 (1768)
Limon spinosum	Mill.	Gard. Dict. ed. 8 : n.º 2 (1768)
Limon racemosum	Mill.	Gard. Dict. ed. 8 : n.º 3 (1768)
Citrus alata	(Tanaka) Tanaka	Syst. Pomol. : 140 (1951)
Citrus aurantium var. proper	Guillaumin	Cit. Cult. Sauv. 36
Citrus aurantium var. tamurana	Yu.Tanaka	Bot. Mag. (Tokyo) 26: 203 1912
Citrus balotina	Poit. & Turpin	Pomol. Franç. 2: t. 349 (1873)
Citrus bicolor	Poit. & Turpin	Pomol. Franç. 2: t. 379 (1873)
Citrus bigena	Poit. & Turpin	Pomol. Franç. 2: t. 378 (1873)
Citrus cedra	Link	Handbuch 2: 346 (1831)
Citrus cedrata	Raf.	Sylva Tellur. : 141 (1838)
Citrus crassa	Hassk.	Cat. Hort. Bot. Bogor. Alt. : 217 (1844)
Citrus fragrans	Salisb.	Prodr. Stirp. Chap. Allerton : 378 (1796)
Citrus gongra	Raf.	Sylva Tellur. : 142 (1838)
Citrus grandis var. pyriformis	(Hassk.) Karaya	Sborn. Nauchn. Trudov Prikl. Bot. Genet. Selekts. 112: 66 (1987)
Citrus hassaku	hort. ex Yu.Tanaka	Icon. Jap. Citrus Fruits 2: 312 (1948)
Citrus hiroshimana	hort. ex Yu.Tanaka	Icon. Jap. Citrus Fruits 1: 191 (1946)
Citrus kizu	hort. ex Yu.Tanaka	Icon. Jap. Citrus Fruits 2: 411 (1948)
Citrus kwangsiensis	Hu	J. Arnold Arbor. 12: 153 (1931)
Citrus limonimedica	Lush.	Indian Forester 36: 348 (1910)
Citrus lumia	Risso	Hist. Nat. Prod. Eur. Mérid. 1: 414 (1826)
Citrus medica var. alata	Tanaka	Trans. Nat. Hist. Soc. Formosa 22: 431 (1932)
Citrus medica var. digitata	Risso ex Guillaumin	Fl. Indo-Chine Suppl. 1: 656 1946
Citrus medica var. dulcis	Risso & Poit.	Hist. Nat. Orang. 2: 201 1819
Citrus medica var. ethrog	Engl.	Nat. Pflanzenfam. 3(4): 199 1896
Citrus medica var. nana	Wester	Philipp. Agric. Rev. 8: 22 (1915)
Citrus medica var. proper	Hook.f.	Fl. Brit. India 1: 514 1875
Citrus medica var. sarcodactylus	(Siebold ex Hoola van Nooten) Swingle	Pl. Wilson. 2(1): 141 1914
Citrus medica f. sudachi	(hort. ex Shirai) M.Hiroe	Forest Pl. Hist. Jap. Islands 1: 221 (1974)
Citrus nana	(Wester) Tanaka	Sp. Problem Citrus : 113 (1954)
Citrus odorata	(Wester) Tanaka	Syst. Pomol. (Kwaju Bunruigaku) 140. 1951
Citrus pyriformis	Hassk.	Flora 25(2, Beibl. 1): 44 (1842)
Citrus sarcodactylis	Hoola van Nooten	Fl. Fr. Feuill. Java 6: [t. 29] (1863)
Citrus sudachi	hort. ex Tanaka	in Stud. Citrol. vii. 74 (1935), japonice.
Citrus tuberosa	Mill.	Gard. Dict. ed. 8 : n.º 2 (1768)
Citrus limonia var. limetta	(Risso) Engl.	Nat. Pflanzenfam. ed. 2 . 19A: 338 1931
Citrus medica subsp. bajoum	H.Perrier	in Fl. Madag. 104: 84 1950
Citrus medica var. limetta	(Risso) Engl.	Nat. Pflanzenfam. 3(4): 200 1896
Citrus medica var. tarung	Yu.Tanaka	Trop. Hort. 7: 8 1937
Citrus aurantium var. medica	(L.) Wight & Arn.	Prodr. Fl. Ind. Orient. 1: 98 1834
Aurantium medicum	M.Gómez	Fl. Habanera 205. 1897
Citrus medica var. odorata	Wester	Philipp. Agric. Rev. 8: 22 (1915)

Common names Top

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Filter by language:

Language	Common/alternative name
English	citron
Spanish	cidro
Spanish	acimboga
Spanish	acimbogo
Spanish	cidral
Spanish	cidras figuradas
Spanish	cidrera
Spanish	cidrero
Spanish	cimboa real
Spanish	sarcodactilis helicteroides
Spanish	toronja alimonada
Amharic	ትርንጎ
Arabic	أترج
Arabic	اترج
Arabic	الأترج
Arabic	ترنج
Arabic	تفاح ماهي
Arabic	ليمون
Arabic	ليمون بلدي
Arabic	ليمون مالح
Bengali	টাবা
br	sedratez
Catalan	naronger
Catalan	naronja
Catalan	poncemer
Catalan	poncir
Catalan	poncem
co	limea
Czech	cedrát
cv	Цитрон
Danish	cedrat
German	zitronatzitrone
German	cedrat
German	zedrat
German	zedratbaum
German	zedratzitrone
Greek	Κιτριά
Greek	Κιτρέα
Greek	Κίτριον
Greek	Κίτρο
Greek	Κίτρον
Esperanto	cedrato
Persian	بالنگ
Finnish	sukaattisitruuna
Finnish	sukaatti
French	cédrat
French	cédratier
frr	sitronaatsitroon
Irish	ciotrón
Irish	crann ciotrón
Galician	cidreira
Gujarati	બીજોરા
Manx	billey kidrane
Hebrew	אתרוג
hif	khatta nabbu
Croatian	Četrun
Upper Sorbian	citronatowa citrona
Indonesian	jeruk sukade
Italian	cedro
Italian	canarone
Japanese	シトロン
Japanese	クエン
Japanese	枸櫞
Kannada	ಹೇರಳೆಕಾಯಿ
Kannada	ಮಾದಳ
Korean	시트론
Lithuanian	citronas
Lithuanian	vaistinis citrinmedis
Latvian	cidrs
Latvian	saldais citrons
Latvian	cedrāts
mad	jherruk katès
Malayalam	citron
Malayalam	ഗണപതിനാരകം
Marathi	महाळुंग
Malay	sitron
nah	cidracuahuitl
Norwegian Bokmål	søtsitron
Norwegian Bokmål	sukatsitron
Norwegian Bokmål	cedrat
Nepali	बिमिरो
Dutch	sukadeboom
Norwegian Nynorsk	sukatsitron
Oromo	turungoo
Oriya	ଟଭାଲେମ୍ବୁ
Polish	cytron
Polish	cedrat
Polish	etrog
Polish	matulinga
Portuguese	cidra
Romanian	chitră
Romanian	chitru
Russian	Цитрон
Russian	Цедрат
Russian	Этрог
sa	नागरङ्गफलम्
sat	ᱡᱟ.ᱢᱵᱤᱨ ᱫᱟᱨᱮ
scn	pirettu
sd	چڪوترو
Slovak	citronát
Slovenian	citrona
Swedish	sukatcitron
Swedish	cedrat
Swedish	sötcitron
Swedish	suckatcitron
Swahili	mfurungu
Tamil	நாரத்தம்பழம்
Telugu	మాదీఫలము
Telugu	మాదీఫలం
Thai	ส้มโอมือ
Thai	มะงั่ว
Turkish	ağaç kavunu
Ukrainian	Цитрон
Vietnamese	thanh yên
yi	אתרוג
yi	אתרוגים
Chinese	云南野香橼
Chinese	云南香橼（变种）
Chinese	佛手
Chinese	佛手（佛手柑）
Chinese	佛手（变种）
Chinese	佛手柑
Chinese	佛手柑根
Chinese	佛手花
Chinese	佛手露
Chinese	枸橼皮
Chinese	枸櫞
Chinese	树葫芦
Chinese	香橼
Chinese	香橼*(枸橼）
Chinese	枸橼
Chinese	蜜罗柑
Chinese	香櫞

Subspecies (abbr. subsp./ssp.) Top

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No subspecies added yet.

Varieties (abbr. var.) Top

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Subvarieties (abbr. subvar.) Top

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Forms (abbr. f.) Top

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Germination/Propagation Top

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No germination or propagation data was added yet.

Distribution (via POWO/KEW) Top

Legend for the distribution data:

- Doubtful data

- Extinct

- Introduced

- Native

Africa click to expand
- Macaronesia
  - Canary Islands
  - Madeira
- Northern Africa
  - Algeria
  - Morocco
  - Tunisia
- West Tropical Africa
  - Benin
  - Mauritania
- Western Indian Ocean
  - Comoros

Asia-temperate click to expand
- Arabian Peninsula
  - Oman
- China
  - China South-central
  - China Southeast
  - Tibet

Asia-tropical click to expand
- Indian Subcontinent
  - Assam
  - Bangladesh
  - East Himalaya
  - India
  - Nepal
  - Sri Lanka
  - West Himalaya
- Indo-China
  - Andaman Islands
  - Laos
  - Myanmar
  - Nicobar Nicobar
  - Vietnam
- Malesia
  - Borneo

Northern America click to expand
- Mexico
  - Mexico Central
  - Mexico Southeast
- Southeastern U.S.A.
  - Alabama
  - Florida

Pacific click to expand
- South-central Pacific
  - Society Islands
- Southwestern Pacific
  - Fiji

Southern America click to expand
- Caribbean
  - Cuba
  - Dominican Republic
  - Haiti
  - Jamaica
  - Leeward Islands
  - Puerto Rico
  - Trinidad-Tobago
- Western South America
  - Ecuador
  - Peru

Links to other databases Top

Suggest others/fix!

Database	ID/link to page
World Flora Online	wfo-0000608140
UNII	944U5Z3O5B
Florida Plant Atlas	1826
Flora of Alabama	3305
USDA Plants	CIME3
Tropicos	28100004
INPN	91811
KEW	urn:lsid:ipni.org:names:59603-2
The Plant List	kew-2724208
Open Tree Of Life	798604
Observations.org	133819
NCBI Taxonomy	171251
Nature Serve	2.128933
IUCN Red List	62041221
IPNI	59603-2
iNaturalist	123356
GBIF	3190157
Freebase	/m/02054x
EPPO	CIDME
EOL	582203
Elurikkus	209966
USDA GRIN	10745
Wikipedia	Citron
CMAUP	NPO11785
CMAUP	NPO15730

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_002013955.2	C_medica_denovo_2	Scaffold	Huazhong Agriculture University	2018-01-24	171.0x	387.25 Mb

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

Investigation of pectin deficiency in modulating the bioflavonoid profile of orange processing waste: A sustainable valorization of industrial waste

de Castro SC, Barbosa JC, Teixeira BS, Fill TP, Tasic L

Food Chem X

26-Mar-2024

PMCID:	PMC10992698
doi:	10.1016/j.fochx.2024.101326
PMID:	38576777

Genome-wide analysis of NPR1-like genes in citrus species and expression analysis in response to citrus canker (Xanthomonas axonopodis pv. citri)

Ali M, Shafiq M, Haider MZ, Sami A, Alam P, Albalawi T, Kamran Z, Sadiq S, Hussain M, Shahid MA, Jeridi M, Ashraf GA, Manzoor MA, Sabir IA

Front Plant Sci

25-Mar-2024

PMCID:	PMC11007782
doi:	10.3389/fpls.2024.1333286
PMID:	38606070

Exploring sustainable management by using green nano-silver to combat three post-harvest pathogenic fungi in crops

Shende SS, Gade AK, Minkina TM, Ingle PU, Rajput VD, Sushkova SN, Mandzhieva SS, Rai M, Wong MH

Discov Nano

19-Mar-2024

PMCID:	PMC10951150
doi:	10.1186/s11671-024-03986-x
PMID:	38503968

Sequential Extraction and Characterization of Essential Oil, Flavonoids, and Pectin from Industrial Orange Waste

Dikmetas DN, Devecioglu D, Karbancioglu-Guler F, Kahveci D

ACS Omega

16-Mar-2024

PMCID:	PMC10976415
doi:	10.1021/acsomega.4c00112
PMID:	38559951

Plant Essential Oils: Dual Action of Toxicity and Egg-Laying Inhibition on Tetranychus urticae (Acari: Tetranychidae), Unveiling Their Potential as Botanical Pesticides

Zhu Y, Wu T, Hu Q, He W, Zheng Y, Xie Y, Rao Q, Liu X

Plants (Basel)

08-Mar-2024

PMCID:	PMC10975855
doi:	10.3390/plants13060763
PMID:	38592755

Uncovering the presence of CVPD disease in citrus varieties of South Sulawesi, Indonesia: A molecular approach

Tuwo M, Kuswinanti T, Nasruddin A, Tambaru E

J Genet Eng Biotechnol

27-Feb-2024

PMCID:	PMC10980848
doi:	10.1016/j.jgeb.2023.100332
PMID:	38494243

The Herbal Combination Shu Gan Jie Yu Regulates the SNCG/ER-a/AKT-ERK Pathway in DMBA-Induced Breast Cancer and Breast Cancer Cell Lines Based on RNA-Seq and IPA Analysis

Zhao Y, Zhao L, Wang T, Liu Z, Tang S, Huang H, Wu L, Sun Y

Integr Cancer Ther

18-Feb-2024

PMCID:	PMC10878215
doi:	10.1177/15347354241233258
PMID:	38369762

Polyphenols and CRISPR as Quorum Quenching Agents in Antibiotic-Resistant Foodborne Human Pathogens (Salmonella Typhimurium, Campylobacter jejuni and Escherichia coli 0157:H7)

Higuera-Ciapara I, Benitez-Vindiola M, Figueroa-Yañez LJ, Martínez-Benavidez E

Foods

15-Feb-2024

PMCID:	PMC10888066
doi:	10.3390/foods13040584
PMID:	38397561

Valorization of saffron (Crocus sativus L.) stigma as a potential natural antioxidant for soybean (Glycine max L.) oil stabilization

Nid Ahmed M, Abourat K, Gagour J, Sakar EH, Majourhat K, Koubachi J, Gharby S

Heliyon

07-Feb-2024

PMCID:	PMC10869852
doi:	10.1016/j.heliyon.2024.e25875
PMID:	38370196

Three-tiered authentication of herbal traditional Chinese medicine ingredients used in women’s health provides progressive qualitative and quantitative insight

Mück F, Scotti F, Mauvisseau Q, Thorbek BL, Wangensteen H, de Boer HJ

Front Pharmacol

05-Feb-2024

PMCID:	PMC10875096
doi:	10.3389/fphar.2024.1353434
PMID:	38375033

Correction: He et al. Biology, Ecology and Management of Tephritid Fruit Flies in China: A Review. Insects 2023, 14, 196

He Y, Xu Y, Chen X

Insects

31-Jan-2024

PMCID:	PMC10889426
doi:	10.3390/insects15020093
PMID:	38392559

Next Generation Sequencing, and Development of a Pipeline as a Tool for the Detection and Discovery of Citrus Pathogens to Facilitate Safer Germplasm Exchange

Keremane M, Singh K, Ramadugu C, Krueger RR, Skaggs TH

Plants (Basel)

30-Jan-2024

PMCID:	PMC10856814
doi:	10.3390/plants13030411
PMID:	38337944

Study on medicinal food plants in the Gaoligongshan Biosphere Reserve, the richest biocultural diversity center in China

Cheng Z, Lin S, Wu Z, Lin C, Zhang Q, Xu C, Li J, Long C

J Ethnobiol Ethnomed

15-Jan-2024

PMCID:	PMC10790445
doi:	10.1186/s13002-023-00638-9
PMID:	38225656

Salmonellosis: An Overview of Epidemiology, Pathogenesis, and Innovative Approaches to Mitigate the Antimicrobial Resistant Infections

Lamichhane B, Mawad AM, Saleh M, Kelley WG, Harrington PJ II, Lovestad CW, Amezcua J, Sarhan MM, El Zowalaty ME, Ramadan H, Morgan M, Helmy YA

Antibiotics (Basel)

13-Jan-2024

PMCID:	PMC10812683
doi:	10.3390/antibiotics13010076
PMID:	38247636

Anti-inflammatory and Antioxidant Activity of Cucumis sativus and Citrus macroptera Herbal Formulation: An In-Vitro Study

Amani T, Surenthar M, Shanmugam R

Cureus

07-Jan-2024

PMCID:	PMC10847068
doi:	10.7759/cureus.51818
PMID:	38327926

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
> Alkaloids and derivatives / Aporphines
(-)-Isoboldine	6971182	Click to see CN1CCC2=CC(=C(C3=C2C1CC4=CC(=C(C=C43)OC)O)O)OC	327.40	unknown	via CMAUP database
Isoboldine	133323	Click to see CN1CCC2=CC(=C(C3=C2C1CC4=CC(=C(C=C43)OC)O)O)OC	327.40	unknown	via CMAUP database
> Alkaloids and derivatives / Pavine alkaloids
(-)-Argemonine	442168	Click to see CN1C2CC3=CC(=C(C=C3C1CC4=CC(=C(C=C24)OC)OC)OC)OC	355.40	unknown	via CMAUP database
(+)-Caryachine	12305286	Click to see CN1C2CC3=CC(=C(C=C3C1CC4=CC5=C(C=C24)OCO5)OC)O	325.40	unknown	via CMAUP database
(1R,12S)-15,16-dimethoxy-20-methyl-5,7-dioxa-20-azapentacyclo[10.7.1.02,10.04,8.013,18]icosa-2,4(8),9,13,15,17-hexaen-1-ol	10948236	Click to see CN1C2CC3=CC4=C(C=C3C1(CC5=CC(=C(C=C25)OC)OC)O)OCO4	355.40	unknown	via CMAUP database
(1R,12S)-23-methyl-5,7,16,18-tetraoxa-23-azahexacyclo[10.10.1.02,10.04,8.013,21.015,19]tricosa-2,4(8),9,13,15(19),20-hexaen-1-ol	11110561	Click to see CN1C2CC3=CC4=C(C=C3C1(CC5=CC6=C(C=C25)OCO6)O)OCO4	339.30	unknown	via CMAUP database
(1R,9R)-5,12-dimethoxy-17-methyl-17-azatetracyclo[7.7.1.02,7.010,15]heptadeca-2,4,6,10,12,14-hexaene-4,13-diol	11869664	Click to see CN1C2CC3=CC(=C(C=C3C1CC4=CC(=C(C=C24)O)OC)OC)O	327.40	unknown	via CMAUP database
(1S,12S,20R)-15-methoxy-20-methyl-20-oxido-5,7-dioxa-20-azoniapentacyclo[10.7.1.02,10.04,8.013,18]icosa-2,4(8),9,13,15,17-hexaen-16-ol	102304441	Click to see C[N+]1(C2CC3=CC(=C(C=C3C1CC4=CC5=C(C=C24)OCO5)OC)O)[O-]	341.40	unknown	via CMAUP database
(1S,12S,20R)-16-methoxy-20-methyl-20-oxido-5,7-dioxa-20-azoniapentacyclo[10.7.1.02,10.04,8.013,18]icosa-2,4(8),9,13,15,17-hexaen-15-ol	102304443	Click to see C[N+]1(C2CC3=CC4=C(C=C3C1CC5=CC(=C(C=C25)O)OC)OCO4)[O-]	341.40	unknown	via CMAUP database
(1S,12S)-15-methoxy-20-methyl-5,7-dioxa-20-azapentacyclo[10.7.1.02,10.04,8.013,18]icosa-2,4(8),9,13,15,17-hexaen-16-ol	11823545	Click to see CN1C2CC3=CC(=C(C=C3C1CC4=CC5=C(C=C24)OCO5)OC)O	325.40	unknown	via CMAUP database
(1S,12S)-16-methoxy-20-methyl-5,7-dioxa-20-azapentacyclo[10.7.1.02,10.04,8.013,18]icosa-2,4(8),9,13,15,17-hexaen-15-ol	44575219	Click to see CN1C2CC3=CC4=C(C=C3C1CC5=CC(=C(C=C25)O)OC)OCO4	325.40	unknown	via CMAUP database
(1S,12S)-5,7,16,18-tetraoxa-23-azahexacyclo[10.10.1.02,10.04,8.013,21.015,19]tricosa-2,4(8),9,13,15(19),20-hexaene	11012304	Click to see C1C2C3=CC4=C(C=C3CC(N2)C5=CC6=C(C=C51)OCO6)OCO4	309.30	unknown	via CMAUP database
(1S,9S)-4,13-dimethoxy-17-methyl-17-azatetracyclo[7.7.1.02,7.010,15]heptadeca-2(7),3,5,10,12,14-hexaene-3,12-diol	92856799	Click to see CN1C2CC3=C(C1CC4=CC(=C(C=C24)O)OC)C(=C(C=C3)OC)O	327.40	unknown	via CMAUP database
Bisnorargemonine	12300156	Click to see CN1C2CC3=CC(=C(C=C3C1CC4=CC(=C(C=C24)O)OC)OC)O	327.40	unknown	via CMAUP database
Caryachine	3082467	Click to see CN1C2CC3=CC4=C(C=C3C1CC5=CC(=C(C=C25)O)OC)OCO4	325.40	unknown	via CMAUP database
Cycloocta(1,2-f:5,6-f')bis(1,3)benzodioxol-5,12-imine, 5,6,12,13-tetrahydro-15-methyl-, (5S)-	193382	Click to see CN1C2CC3=CC4=C(C=C3C1CC5=CC6=C(C=C25)OCO6)OCO4	323.30	unknown	via CMAUP database
Escholtzine	12304178	Click to see CN1C2CC3=CC4=C(C=C3C1CC5=CC6=C(C=C25)OCO6)OCO4	323.30	unknown	via CMAUP database
> Alkaloids and derivatives / Proaporphines
(+)-8,9-Dihydrostepharine	13819281	Click to see COC1=C(C2=C3C(CC24CCC(=O)C=C4)NCCC3=C1)OC	299.40	unknown	via CMAUP database
(1'S,2S,4R)-10-methoxy-5-methylspiro[5-azatricyclo[6.3.1.04,12]dodeca-1(12),8,10-triene-2,4'-cyclohex-2-ene]-1',11-diol	10870351	Click to see CN1CCC2=CC(=C(C3=C2C1CC34CCC(C=C4)O)O)OC	301.40	unknown	via CMAUP database
Isoamuronine	12306127	Click to see CN1CCC2=CC(=C(C3=C2C1CC34CCC(=O)C=C4)OC)OC	313.40	unknown	via CMAUP database
> Alkaloids and derivatives / Protoberberine alkaloids and derivatives
Berberine	2353	Click to see COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC5=C(C=C4CC3)OCO5)OC	336.40	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acids
4-(3-Methylbut-2-enoxy)benzoic acid	267137	Click to see CC(=CCOC1=CC=C(C=C1)C(=O)O)C	206.24	unknown	https://doi.org/10.1248/CPB.36.3292
Benzoic Acid	243	Click to see C1=CC=C(C=C1)C(=O)O	122.12	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/NP060217S
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / O-methoxybenzoic acids and derivatives
4-Hydroxy-2-methoxybenzoic acid	12695575	Click to see COC1=C(C=CC(=C1)O)C(=O)O	168.15	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Phenylpropanes
2-(4-Methylphenyl)propan-2-ol	14529	Click to see CC1=CC=C(C=C1)C(C)(C)O	150.22	unknown	via CMAUP database
> Benzenoids / Indanes / Indanones
(2R-trans)-2,3-Dihydro-3-hydroxy-6-(2-hydroxyethyl)-2,5,7-trimethyl-1H-inden-1-one	169729	Click to see CC1C(C2=C(C1=O)C(=C(C(=C2)C)CCO)C)O	234.29	unknown	via CMAUP database
(2R)-2-hydroxy-6-(2-hydroxyethyl)-2,5,7-trimethyl-3H-inden-1-one	46849571	Click to see CC1=CC2=C(C(=C1CCO)C)C(=O)C(C2)(C)O	234.29	unknown	via CMAUP database
(2S-trans)-6-(2-Chloroethyl)-2,3-dihydro-3-hydroxy-2,5,7-trimethyl-1H-inden-1-one	148419	Click to see CC1C(C2=C(C1=O)C(=C(C(=C2)C)CCCl)C)O	252.73	unknown	via CMAUP database
(2S,3R)-3-hydroxy-6-(2-hydroxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one	46850078	Click to see CC1C(C2=C(C1=O)C(=C(C(=C2)C)CCO)C)O	234.29	unknown	via CMAUP database
(2S)-6-(2-hydroxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one	12314748	Click to see CC1CC2=C(C1=O)C(=C(C(=C2)C)CCO)C	218.29	unknown	via CMAUP database
(3R)-6-(2-chloroethyl)-3-hydroxy-2,2,5,7-tetramethyl-3H-inden-1-one	23260004	Click to see CC1=CC2=C(C(=C1CCCl)C)C(=O)C(C2O)(C)C	266.76	unknown	via CMAUP database
(3S)-3-hydroxy-6-(2-hydroxyethyl)-2,2,5,7-tetramethyl-3H-inden-1-one	71361396	Click to see CC1=CC2=C(C(=C1CCO)C)C(=O)C(C2O)(C)C	248.32	unknown	via CMAUP database
(S)-2,3-Dihydro-2-(hydroxymethyl)-6-(2-methoxyethyl)-2,5,7-trimethyl-1H-inden-1-one	134443	Click to see CC1=CC2=C(C(=C1CCOC)C)C(=O)C(C2)(C)CO	262.34	unknown	via CMAUP database
(S)-2,3-Dihydro-6-(2-hydroxyethyl)-2-(hydroxymethyl)-5,7-dimethyl-1H-inden-1-one	169739	Click to see CC1=CC2=C(C(=C1CCO)C)C(=O)C(C2)CO	234.29	unknown	via CMAUP database
(S)-2,3-Dihydro-6-(2-hydroxyethyl)-5-(hydroxymethyl)-2,7-dimethyl-1H-inden-1-one	151323	Click to see CC1CC2=CC(=C(C(=C2C1=O)C)CCO)CO	234.29	unknown	via CMAUP database
1-Indanone	6735	Click to see C1CC(=O)C2=CC=CC=C21	132.16	unknown	via CMAUP database
2S,3S-acetylpterosin C	21122778	Click to see CC1C(C2=C(C1=O)C(=C(C(=C2)C)CCOC(=O)C)C)O	276.33	unknown	via CMAUP database
Epipterosin L	46848746	Click to see CC1=CC2=C(C(=C1CCO)C)C(=O)C(C2O)(C)CO	264.32	unknown	via CMAUP database
Pterosin A	135017	Click to see CC1=CC2=C(C(=C1CCO)C)C(=O)C(C2)(C)CO	248.32	unknown	via CMAUP database
Pterosin B	115049	Click to see CC1CC2=C(C1=O)C(=C(C(=C2)C)CCO)C	218.29	unknown	via CMAUP database
Pterosin C	186209	Click to see CC1C(C2=C(C1=O)C(=C(C(=C2)C)CCO)C)O	234.29	unknown	via CMAUP database
Pterosin D	147559	Click to see CC1=CC2=C(C(=C1CCO)C)C(=O)C(C2O)(C)C	248.32	unknown	via CMAUP database
Pterosin E	148588	Click to see CC1CC2=C(C1=O)C(=C(C(=C2)C)CC(=O)O)C	232.27	unknown	via CMAUP database
Pterosin H	135029	Click to see CC1=CC2=C(C(=C1CCCl)C)C(=O)C(C2)(C)C	250.76	unknown	via CMAUP database
Pterosin I	161891	Click to see CC1=CC2=C(C(=C1CCOC)C)C(=O)C(C2)(C)C	246.34	unknown	via CMAUP database
Pterosin K	148420	Click to see CC1=CC2=C(C(=C1CCCl)C)C(=O)C(C2)(C)CO	266.76	unknown	via CMAUP database
Pterosin L	21633068	Click to see CC1=CC2=C(C(=C1CCO)C)C(=O)C(C2O)(C)CO	264.32	unknown	via CMAUP database
Pterosin O	135255	Click to see CC1CC2=C(C1=O)C(=C(C(=C2)C)CCOC)C	232.32	unknown	via CMAUP database
Pterosin Z	134977	Click to see CC1=CC2=C(C(=C1CCO)C)C(=O)C(C2)(C)C	232.32	unknown	via CMAUP database
Pterosinf	46849741	Click to see CC1CC2=C(C1=O)C(=C(C(=C2)C)CCCl)C	236.73	unknown	via CMAUP database
> Benzenoids / Phenols / 1-hydroxy-2-unsubstituted benzenoids
(-)-Synephrine	854067	Click to see CNCC(C1=CC=C(C=C1)O)O	167.20	unknown	via CMAUP database
(+)-Synephrine	667452	Click to see CNCC(C1=CC=C(C=C1)O)O	167.20	unknown	via CMAUP database
(R)-synephrine	6951208	Click to see C[NH2+]CC(C1=CC=C(C=C1)O)O	168.21	unknown	via CMAUP database
Synephrine	7172	Click to see CNCC(C1=CC=C(C=C1)O)O	167.20	unknown	via CMAUP database
> Benzenoids / Phenols / Tyrosols and derivatives
Etrogol	10398072	Click to see CC(=CCOC1=CC=C(C=C1)CCO)C	206.28	unknown	https://doi.org/10.1248/CPB.36.3292
> Hydrocarbons / Saturated hydrocarbons / Alkanes
Decane	15600	Click to see CCCCCCCCCC	142.28	unknown	via CMAUP database
Docosane	12405	Click to see CCCCCCCCCCCCCCCCCCCCCC	310.60	unknown	via CMAUP database
Eicosane	8222	Click to see CCCCCCCCCCCCCCCCCCCC	282.50	unknown	via CMAUP database
> Hydrocarbons / Unsaturated hydrocarbons / Branched unsaturated hydrocarbons
gamma-Terpinene	7461	Click to see CC1=CCC(=CC1)C(C)C	136.23	unknown	https://doi.org/10.1002/FFJ.2730100602 https://doi.org/10.1021/JF60196A027 https://doi.org/10.1080/10412905.1996.9700547
> Lignans, neolignans and related compounds
Krukovine	10257912	Click to see CN1CCC2=CC(=C3C=C2C1CC4=CC=C(C=C4)OC5=C(C=CC(=C5)CC6C7=C(O3)C(=C(C=C7CCN6C)OC)O)O)OC	594.70	unknown	via CMAUP database
> Lignans, neolignans and related compounds / Furanoid lignans
Syringaresinol	100067	Click to see COC1=CC(=CC(=C1O)OC)C2C3COC(C3CO2)C4=CC(=C(C(=C4)OC)O)OC	418.40	unknown	https://doi.org/10.1248/CPB.58.61
Syringaresinol, (+)-	443023	Click to see COC1=CC(=CC(=C1O)OC)C2C3COC(C3CO2)C4=CC(=C(C(=C4)OC)O)OC	418.40	unknown	https://doi.org/10.1248/CPB.58.61
> Lignans, neolignans and related compounds / Furanoid lignans / Tetrahydrofuran lignans / 9,9-epoxylignans / Dibenzylbutyrolactone lignans
Suchilactone	10915582	Click to see COC1=C(C=C(C=C1)CC2COC(=O)C2=CC3=CC4=C(C=C3)OCO4)OC	368.40	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids
Palmitoleic Acid	445638	Click to see CCCCCCC=CCCCCCCCC(=O)O	254.41	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Medium-chain fatty acids
Lauric Acid	3893	Click to see CCCCCCCCCCCC(=O)O	200.32	unknown	via CMAUP database
Pteridicacid A	11013967	Click to see CCC1C=CC2(C(C(C(C(O2)C(C)C=CC=CC(=O)O)C)O)C)OC1C	364.50	unknown	via CMAUP database
Pteridicacid B	10883014	Click to see CCC1C=CC2(C(C(C(C(O2)C(C)C=CC=CC(=O)O)C)O)C)OC1C	364.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohol esters
Citronellyl acetate	9017	Click to see CC(CCC=C(C)C)CCOC(=O)C	198.30	unknown	via CMAUP database
Decyl acetate	8167	Click to see CCCCCCCCCCOC(=O)C	200.32	unknown	via CMAUP database
Geranyl acetate	1549026	Click to see CC(=CCCC(=CCOC(=O)C)C)C	196.29	unknown	https://doi.org/10.1080/10412905.1996.9700547
Neryl acetate	1549025	Click to see CC(=CCCC(=CCOC(=O)C)C)C	196.29	unknown	https://doi.org/10.1080/10412905.1996.9700547
Nonyl acetate	8918	Click to see CCCCCCCCCOC(=O)C	186.29	unknown	via CMAUP database
Octyl acetate	8164	Click to see CCCCCCCCOC(=O)C	172.26	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty aldehydes
Hexadecanal	984	Click to see CCCCCCCCCCCCCCCC=O	240.42	unknown	via CMAUP database
Tetradecanal	31291	Click to see CCCCCCCCCCCCCC=O	212.37	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Lineolic acids and derivatives
Linoleic Acid	5280450	Click to see CCCCCC=CCC=CCCCCCCCC(=O)O	280.40	unknown	via CMAUP database
> Lipids and lipid-like molecules / Glycerolipids / Triradylcglycerols / Triacylglycerols
Tripalmitin	11147	Click to see CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC	807.30	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids
alpha-Tocopherolquinone	2734086	Click to see CC1=C(C(=O)C(=C(C1=O)C)CCC(C)(CCCC(C)CCCC(C)CCCC(C)C)O)C	446.70	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids
(-)-Citronellol	7793	Click to see CC(CCC=C(C)C)CCO	156.26	unknown	via CMAUP database
(+)-Linalyl acetate	6999980	Click to see CC(=CCCC(C)(C=C)OC(=O)C)C	196.29	unknown	via CMAUP database
(2E)-2,3,7-trimethylocta-2,6-dienoate	22565016	Click to see CC(=CCCC(=C(C)C(=O)[O-])C)C	181.25	unknown	via CMAUP database
(R)-(+)-Citronellal	75427	Click to see CC(CCC=C(C)C)CC=O	154.25	unknown	via CMAUP database
(S)-(-)-Citronellal	443157	Click to see CC(CCC=C(C)C)CC=O	154.25	unknown	via CMAUP database
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
3,7-Dimethyl-2,6-octadien-1-al	8843	Click to see CC(=CCCC(=CC=O)C)C	152.23	unknown	https://doi.org/10.1021/JA01245A053 https://doi.org/10.3892/IJMM.2014.1720
3,7-Dimethyl-6-octen-1-ylacetate	21612892	Click to see CC(CCCC(=O)[O-])CCC=C(C)C	197.29	unknown	via CMAUP database
beta-CITRONELLOL, (+/-)-	8842	Click to see CC(CCC=C(C)C)CCO	156.26	unknown	via CMAUP database
beta-OCIMENE, (3E)-	5281553	Click to see CC(=CCC=C(C)C=C)C	136.23	unknown	https://doi.org/10.1080/10412905.1996.9700547
beta-Ocimene, (3Z)-	5320250	Click to see CC(=CCC=C(C)C=C)C	136.23	unknown	https://doi.org/10.1080/10412905.1996.9700547
Citral	638011	Click to see CC(=CCCC(=CC=O)C)C	152.23	unknown	https://doi.org/10.1080/10412905.1996.9700547 https://doi.org/10.1021/JA01245A053
Citronellal	7794	Click to see CC(CCC=C(C)C)CC=O	154.25	unknown	https://doi.org/10.1080/10412905.1996.9700547
D-Citronellol	101977	Click to see CC(CCC=C(C)C)CCO	156.26	unknown	via CMAUP database
Geraniol	637566	Click to see CC(=CCCC(=CCO)C)C	154.25	unknown	https://doi.org/10.1080/10412905.1996.9700547
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	https://doi.org/10.1080/10412905.1996.9700547
Linalyl acetate	8294	Click to see CC(=CCCC(C)(C=C)OC(=O)C)C	196.29	unknown	via CMAUP database
Methyl geranate	5365910	Click to see CC(=CCCC(=CC(=O)OC)C)C	182.26	unknown	via CMAUP database
Methyl-3,7-dimethyl-2,6-octadienoate	70917	Click to see CC(=CCCC(=CC(=O)OC)C)C	182.26	unknown	via CMAUP database
Myrcene	31253	Click to see CC(=CCCC(=C)C=C)C	136.23	unknown	https://doi.org/10.1080/10412905.1996.9700547
Neral	643779	Click to see CC(=CCCC(=CC=O)C)C	152.23	unknown	https://doi.org/10.3892/IJMM.2014.1720 https://doi.org/10.1080/10412905.1996.9700547
Nerol	643820	Click to see CC(=CCCC(=CCO)C)C	154.25	unknown	https://doi.org/10.1080/10412905.1996.9700547
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Aromatic monoterpenoids
2-(3,7-Dimethylocta-1,6-dien-3-yl)benzoate	22447367	Click to see CC(=CCCC(C)(C=C)C1=CC=CC=C1C(=O)[O-])C	257.35	unknown	via CMAUP database
Carvacrol	10364	Click to see CC1=C(C=C(C=C1)C(C)C)O	150.22	unknown	via CMAUP database
p-CYMENE	7463	Click to see CC1=CC=C(C=C1)C(C)C	134.22	unknown	https://doi.org/10.1080/10412905.1996.9700547
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids
(-)-(1S,4S)-Borneol	6850744	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
(-)-3-Carene	442461	Click to see CC1=CCC2C(C1)C2(C)C	136.23	unknown	via CMAUP database
(-)-alpha-Pinene	440968	Click to see CC1=CCC2CC1C2(C)C	136.23	unknown	via CMAUP database
(-)-beta-Pinene	440967	Click to see CC1(C2CCC(=C)C1C2)C	136.23	unknown	via CMAUP database
(-)-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
(-)-Sabinene	11051711	Click to see CC(C)C12CCC(=C)C1C2	136.23	unknown	via CMAUP database
(+)-3-Carene	443156	Click to see CC1=CCC2C(C1)C2(C)C	136.23	unknown	via CMAUP database
(+)-alpha-Pinene	82227	Click to see CC1=CCC2CC1C2(C)C	136.23	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
(1R,2S,4R)-Borneol	439568	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
(1R)-2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-2-ene	6451618	Click to see CC1=CCC2(C1C2)C(C)C	136.23	unknown	https://doi.org/10.1080/10412905.1996.9700547
(1S-endo)-1,7,7-trimethylbicyclo(2.2.1)heptan-2-ol	10049	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
(1S,2S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol	12242815	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
(1S,4R)-4-methyl-1-propan-2-ylbicyclo[3.1.0]hexane	101629835	Click to see CC1CCC2(C1C2)C(C)C	138.25	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
1,4-Cineole	10106	Click to see CC(C)C12CCC(O1)(CC2)C	154.25	unknown	via CMAUP database
1,7,7-Trimethylbicyclo[2.2.1]heptan-2-ol	64685	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
3-Carene	26049	Click to see CC1=CCC2C(C1)C2(C)C	136.23	unknown	via CMAUP database
alpha-Bergamotene	86608	Click to see CC1=CCC2CC1C2(C)CCC=C(C)C	204.35	unknown	https://doi.org/10.1002/HLCA.19630460729
alpha-Bergamotene, (E)-(-)-	6429302	Click to see CC1=CCC2CC1C2(C)CCC=C(C)C	204.35	unknown	https://doi.org/10.1002/HLCA.19630460729 https://doi.org/10.1080/10412905.1996.9700547
alpha-CIS-BERGAMOTENE	6429303	Click to see CC1=CCC2CC1C2(C)CCC=C(C)C	204.35	unknown	via CMAUP database
alpha-PINENE	6654	Click to see CC1=CCC2CC1C2(C)C	136.23	unknown	https://doi.org/10.1080/10412905.1996.9700547
beta-Pinene	14896	Click to see CC1(C2CCC(=C)C1C2)C	136.23	unknown	https://doi.org/10.1080/10412905.1996.9700547 https://doi.org/10.1021/JF60196A027
beta-Thujene	520384	Click to see CC1C=CC2(C1C2)C(C)C	136.23	unknown	via CMAUP database
Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, exo-	439569	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	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	https://doi.org/10.1080/10412905.1996.9700547
Borneo camphor	12242824	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
Borneol	6552009	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
Borneol, (-)-	1201518	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
Camphene	6616	Click to see CC1(C2CCC(C2)C1=C)C	136.23	unknown	https://doi.org/10.1080/10412905.1996.9700547
Camphor	2537	Click to see CC1(C2CCC1(C(=O)C2)C)C	152.23	unknown	https://doi.org/10.1080/10412905.1996.9700547
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
d-Camphor	230921	Click to see CC1(C2CCC1(C(=O)C2)C)C	152.23	unknown	via CMAUP database
DL-Borneol	10492	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
Pinocamphone	6427105	Click to see CC1C2CC(C2(C)C)CC1=O	152.23	unknown	via CMAUP database
Sabinen	18818	Click to see CC(C)C12CCC(=C)C1C2	136.23	unknown	https://doi.org/10.1080/10412905.1996.9700547
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
Sumatra camphor	657014	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
trans-alpha-Bergaptene	6428986	Click to see CC1=CCC2CC1C2(C)CCC=C(C)C	204.35	unknown	via CMAUP database
trans-Borneol	44630107	Click to see CC1(C2CCC1(C(C2)O)C)C	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
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Menthane monoterpenoids
(-)-alpha-Terpineol	443162	Click to see CC1=CCC(CC1)C(C)(C)O	154.25	unknown	https://doi.org/10.1021/JA01245A053
(-)-beta-Phellandrene	443161	Click to see CC(C)C1CCC(=C)C=C1	136.23	unknown	via CMAUP database
(-)-Terpinen-4-ol	5325830	Click to see CC1=CCC(CC1)(C(C)C)O	154.25	unknown	via CMAUP database
(+)-alpha-Phellandrene	443160	Click to see CC1=CCC(C=C1)C(C)C	136.23	unknown	via CMAUP database
(+)-Perillaldehyde	1548901	Click to see CC(=C)C1CCC(=CC1)C=O	150.22	unknown	via CMAUP database
(+)-Terpinen-4-ol	2724161	Click to see CC1=CCC(CC1)(C(C)C)O	154.25	unknown	via CMAUP database
(1S,2S,4R)-Limonene-1,2-diol	441246	Click to see CC(=C)C1CCC(C(C1)O)(C)O	170.25	unknown	https://doi.org/10.1021/NP060217S
(6S)-6-(2-hydroxypropan-2-yl)-3-methylcyclohex-2-en-1-one	13967632	Click to see CC1=CC(=O)C(CC1)C(C)(C)O	168.23	unknown	https://doi.org/10.1021/NP060217S
1,2-Cyclohexanediol, 1-methyl-4-(1-methylethenyl)-	94217	Click to see CC(=C)C1CCC(C(C1)O)(C)O	170.25	unknown	https://doi.org/10.1021/NP060217S
2-Cyclohexen-1-one, 6-(1-hydroxy-1-methylethyl)-3-methyl-	557484	Click to see CC1=CC(=O)C(CC1)C(C)(C)O	168.23	unknown	https://doi.org/10.1021/NP060217S
4-Terpineol, (+/-)-	11230	Click to see CC1=CCC(CC1)(C(C)C)O	154.25	unknown	https://doi.org/10.1021/JF60196A027 https://doi.org/10.1080/10412905.1996.9700547
alpha-PHELLANDRENE	7460	Click to see CC1=CCC(C=C1)C(C)C	136.23	unknown	via CMAUP database
alpha-PHELLANDRENE, (-)-	442482	Click to see CC1=CCC(C=C1)C(C)C	136.23	unknown	via CMAUP database
alpha-Terpinene	7462	Click to see CC1=CC=C(CC1)C(C)C	136.23	unknown	https://doi.org/10.1080/10412905.1996.9700547
Alpha-Terpineol	17100	Click to see CC1=CCC(CC1)C(C)(C)O	154.25	unknown	https://doi.org/10.1080/10412905.1996.9700547 https://doi.org/10.1021/JA01245A053
Beta-Phellandrene	11142	Click to see CC(C)C1CCC(=C)C=C1	136.23	unknown	https://doi.org/10.1002/FFJ.2730100602
Limonene, (-)-	439250	Click to see CC1=CCC(CC1)C(=C)C	136.23	unknown	via CMAUP database
Limonene, (+)-	440917	Click to see CC1=CCC(CC1)C(=C)C	136.23	unknown	https://doi.org/10.1021/JA01245A053
Limonene, (+/-)-	22311	Click to see CC1=CCC(CC1)C(=C)C	136.23	unknown	https://doi.org/10.1080/10412905.1996.9700547 https://doi.org/10.1002/FFJ.2730100602 https://doi.org/10.1021/JA01245A053
Perillaldehyde	16441	Click to see CC(=C)C1CCC(=CC1)C=O	150.22	unknown	via CMAUP database
Perillaldehyde, (-)-	2724159	Click to see CC(=C)C1CCC(=CC1)C=O	150.22	unknown	via CMAUP database
Piperitone	6987	Click to see CC1=CC(=O)C(CC1)C(C)C	152.23	unknown	https://doi.org/10.1080/10412905.1996.9700547
Terpinolene	11463	Click to see CC1=CCC(=C(C)C)CC1	136.23	unknown	https://doi.org/10.1080/10412905.1996.9700547
> 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
(+)(-)-(E)-beta-caryophyllene	14757966	Click to see CC1(CC2C1CCC(=C)CCCC2=C)C	204.35	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)-beta-bisabolene	68128	Click to see CC1=CCC(CC1)C(=C)CCC=C(C)C	204.35	unknown	https://doi.org/10.1080/10412905.1996.9700547
(Z)-alpha-Bisabolene	5352653	Click to see CC1=CCC(CC1)C(=CCC=C(C)C)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-Methyl-4-(6-methylhept-5-en-2-ylidene)cyclohex-1-ene	62346	Click to see CC1=CCC(=C(C)CCC=C(C)C)CC1	204.35	unknown	https://doi.org/10.1021/JA01245A053
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
1H-Cyclopenta[1,3]cyclopropa[1,2]benzene, octahydro-7-methyl-3-methylene-4-(1-methylethyl)-, [3aS-(3aalpha,3bbeta,4beta,7alpha,7aS*)]-	6432083	Click to see CC1CCC(C2C13C2C(=C)CC3)C(C)C	204.35	unknown	via CMAUP database
2-Isopropenyl-1-methyl-4-(1-methylethylidene)-1-vinylcyclohexane	6432312	Click to see CC(=C1CCC(C(C1)C(=C)C)(C)C=C)C	204.35	unknown	via CMAUP database
2,3-Dimethyl-3-(4-methyl-3-pentenyl)-2-norbornanol	6429259	Click to see CC(=CCCC1(C2CCC(C2)C1(C)O)C)C	222.37	unknown	via CMAUP database
3-Cyclohexen-1-ol, 1-(1,5-dimethyl-4-hexenyl)-4-methyl-	27208	Click to see CC1=CCC(CC1)(C(C)CCC=C(C)C)O	222.37	unknown	via CMAUP database
alpha-Bisabolol	10586	Click to see CC1=CCC(CC1)C(C)(CCC=C(C)C)O	222.37	unknown	via CMAUP database
beta-Bisabolene	10104370	Click to see CC1=CCC(CC1)C(=C)CCC=C(C)C	204.35	unknown	https://doi.org/10.1080/10412905.1996.9700547
beta-CARYOPHYLLENE OXIDE	1742210	Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C	220.35	unknown	https://doi.org/10.1080/10412905.1996.9700547
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
beta-Ionone	638014	Click to see CC1=C(C(CCC1)(C)C)C=CC(=O)C	192.30	unknown	https://doi.org/10.1080/10412905.1996.9700547
Bisabolol	1549992	Click to see CC1=CCC(CC1)C(C)(CCC=C(C)C)O	222.37	unknown	via CMAUP database
Campherenol	91747494	Click to see CC(=CCCC1(C2CCC1(C(C2)O)C)C)C	222.37	unknown	via CMAUP database
Caryophyllene	5281515	Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C	204.35	unknown	https://doi.org/10.1080/10412905.1996.9700547
Caryophyllene epoxide	14350	Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C	220.35	unknown	https://doi.org/10.1080/10412905.1996.9700547
Caryophyllene,alpha + beta mixt.	5354499	Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C	204.35	unknown	via CMAUP database
cis-beta-Santalene	6430549	Click to see CC(=CCCC1(C2CCC(C2)C1=C)C)C	204.35	unknown	via CMAUP database
Cubebene	518814	Click to see CC1CCC(C2C13C2C(=C)CC3)C(C)C	204.35	unknown	via CMAUP database
Cyclohexene, 4-((1Z)-1,5-dimethyl-1,4-hexadienyl)-1-methyl-, (4S)-	24798702	Click to see CC1=CCC(CC1)C(=CCC=C(C)C)C	204.35	unknown	via CMAUP database
delta-Cadinene	12306054	Click to see CC1=CC2C(CCC(=C2CC1)C)C(C)C	204.35	unknown	via CMAUP database
gamma-BISABOLENE, (E)-	5352437	Click to see CC1=CCC(=C(C)CCC=C(C)C)CC1	204.35	unknown	via CMAUP database
gamma-Bisabolene, (Z)-	3033866	Click to see CC1=CCC(=C(C)CCC=C(C)C)CC1	204.35	unknown	https://doi.org/10.1021/JA01245A053
gamma-Elemene	94254	Click to see CC(=C1CCC(C(C1)C(=C)C)(C)C=C)C	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/10.1080/10412905.1996.9700547
Isocaryophyllene	5281522	Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C	204.35	unknown	via CMAUP database
Levomenol	442343	Click to see CC1=CCC(CC1)C(C)(CCC=C(C)C)O	222.37	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
Norbornane, 2-methyl-3-methylene-2-(4-methyl-3-pentenyl)-	10534	Click to see CC(=CCCC1(C2CCC(C2)C1=C)C)C	204.35	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Agarofurans
[(1R,2S,5R,6R,7R,9R)-7-acetyloxy-5-hydroxy-6-(hydroxymethyl)-2,10,10-trimethyl-11-oxatricyclo[7.2.1.01,6]dodecan-8-yl] benzoate	6325577	Click to see CC1CCC(C2(C13CC(C(C2OC(=O)C)OC(=O)C4=CC=CC=C4)C(O3)(C)C)CO)O	432.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Aromadendrane sesquiterpenoids / 5,10-cycloaromadendrane sesquiterpenoids
(1aS,4aS,7S,7aR,7bS)-1,1,7-trimethyl-4-methylidene-1a,2,3,4a,5,6,7a,7b-octahydrocyclopropa[h]azulen-7-ol	97032059	Click to see CC1(C2C1C3C(CCC3(C)O)C(=C)CC2)C	220.35	unknown	https://doi.org/10.1080/10412905.1996.9700547
(7aR)-1,1,7-trimethyl-4-methylidene-1a,2,3,4a,5,6,7a,7b-octahydrocyclopropa[h]azulen-7-ol	5321422	Click to see CC1(C2C1C3C(CCC3(C)O)C(=C)CC2)C	220.35	unknown	https://doi.org/10.1080/10412905.1996.9700547
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Bicyclogermacrane and isolepidozane sesquiterpenoids
(+)-Bicyclogermacrene	11820258	Click to see CC1=CCCC(=CC2C(C2(C)C)CC1)C	204.35	unknown	via CMAUP database
(1S,2E,10R)-3,7,11,11-tetramethylbicyclo[8.1.0]undeca-2,6-diene	44583886	Click to see CC1=CCCC(=CC2C(C2(C)C)CC1)C	204.35	unknown	via CMAUP database
(1S,2E,6E,10R)-3,7,11,11-tetramethylbicyclo[8.1.0]undeca-2,6-diene	13894537	Click to see CC1=CCCC(=CC2C(C2(C)C)CC1)C	204.35	unknown	via CMAUP database
(1S,2Z,6Z,10R)-3,7,11,11-tetramethylbicyclo[8.1.0]undeca-2,6-diene	13894533	Click to see CC1=CCCC(=CC2C(C2(C)C)CC1)C	204.35	unknown	via CMAUP database
Bicyclogermacrene	5315347	Click to see CC1=CCCC(=CC2C(C2(C)C)CC1)C	204.35	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Elemane sesquiterpenoids
(-)-cis-beta-Elemene	6431151	Click to see CC(=C)C1CCC(C(C1)C(=C)C)(C)C=C	204.35	unknown	via CMAUP database
Beta-Elemene	6918391	Click to see CC(=C)C1CCC(C(C1)C(=C)C)(C)C=C	204.35	unknown	https://doi.org/10.1002/FFJ.2730100602
Cyclohexane, 1-ethenyl-1-methyl-2,4-bis(1-methylethenyl)-, (1R,2R,4S)-	9859094	Click to see CC(=C)C1CCC(C(C1)C(=C)C)(C)C=C	204.35	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eremophilane, 8,9-secoeremophilane and furoeremophilane sesquiterpenoids
(-)-Nootkatone	7567181	Click to see CC1CC(=O)C=C2C1(CC(CC2)C(=C)C)C	218.33	unknown	via CMAUP database
Nootkatone	1268142	Click to see CC1CC(=O)C=C2C1(CC(CC2)C(=C)C)C	218.33	unknown	via CMAUP database
Valencene	9855795	Click to see CC1CCC=C2C1(CC(CC2)C(=C)C)C	204.35	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-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
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides
Ptaquiloside Z	101242525	Click to see CC1=CC2(CC(C(=O)C2C(C13CC3)(C)O)(C)C)OC4C(C(C(C(O4)CO)O)O)O	412.50	unknown	via CMAUP database
Pteridanoside	11795946	Click to see CC1(CC2C(C1=O)C3(CCC3=C(C2O)COC4C(C(C(C(O4)CO)O)O)O)C)C	412.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones
Ichangin	441801	Click to see CC12CCC3C(C14C(O4)C(=O)OC2C5=COC=C5)(C(=O)CC(C36COC(=O)CC6O)C(C)(C)O)C	488.50	unknown	https://doi.org/10.2503/JJSHS.58.227
Xanthotoxol geranyl ether	5317564	Click to see CC(=CCCC(=CCOC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2)C)C	338.40	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Tetraterpenoids / Carotenoids / Carotenes
(12E,14E,16Z,18E,20E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,12,14,16,18,20,30-heptaene	16061225	Click to see CC(CCCC(C)CC=CC(=CC=CC=C(C)C=CCC(C)CCCC(C)CCC=C(C)C)C)CCC=C(C)C	549.00	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
(1S,3aR,5aR,5bR,7aR,9S,11aR,11bR,13aS,13bS)-3a,5a,5b,8,8,11a-hexamethyl-1-propan-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol	162975999	Click to see CC(C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C	428.70	unknown	https://doi.org/10.1248/CPB.58.61
3beta-3-Lupanol	610269	Click to see CC(C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C	428.70	unknown	https://doi.org/10.1248/CPB.58.61
beta-Citraurin	9845703	Click to see CC1=C(C(CC(C1)O)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=O)C)C	432.60	unknown	via CMAUP database
Friedelan-3-one	244297	Click to see CC1C(=O)CCC2C1(CCC3C2(CCC4(C3(CCC5(C4CC(CC5)(C)C)C)C)C)C)C	426.70	unknown	https://doi.org/10.3987/COM-99-8782
Friedelin	91472	Click to see CC1C(=O)CCC2C1(CCC3C2(CCC4(C3(CCC5(C4CC(CC5)(C)C)C)C)C)C)C	426.70	unknown	https://doi.org/10.3987/COM-99-8782
Lup-20(29)-en-3-ol, (3beta)-	521518	Click to see CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C	426.70	unknown	https://doi.org/10.3987/COM-08-11630
Lupeol	259846	Click to see CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C	426.70	unknown	https://doi.org/10.3987/COM-08-11630
Squalene	638072	Click to see CC(=CCCC(=CCCC(=CCCC=C(C)CCC=C(C)CCC=C(C)C)C)C)C	410.70	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids / Limonoids
(1R,2R,4S,7R,8S,11R,12R,13S,18R)-13-hydroxy-7-[(2R)-2-hydroxy-5-oxo-2H-furan-4-yl]-1,8,12,17,17-pentamethyl-3,6,16-trioxapentacyclo[9.9.0.02,4.02,8.012,18]icosane-5,15,20-trione	163022347	Click to see CC1(C2CC(=O)C3(C(C2(C(CC(=O)O1)O)C)CCC4(C35C(O5)C(=O)OC4C6=CC(OC6=O)O)C)C)C	504.50	unknown	https://doi.org/10.1021/NP060217S
(1R,2R,4S,7R,8S,11R,12R,18R)-7-[(2R)-2-hydroxy-5-oxo-2H-furan-4-yl]-1,8,12,17,17-pentamethyl-3,6,16-trioxapentacyclo[9.9.0.02,4.02,8.012,18]icos-13-ene-5,15,20-trione	124389670	Click to see CC1(C2CC(=O)C3(C(C2(C=CC(=O)O1)C)CCC4(C35C(O5)C(=O)OC4C6=CC(OC6=O)O)C)C)C	486.50	unknown	https://doi.org/10.1248/CPB.49.649
(1S,2R,7S,10R,13R,14R,16S,19S,20S)-19-(furan-3-yl)-9,9,13,20-tetramethyl-4,8,15,18-tetraoxahexacyclo[11.9.0.02,7.02,10.014,16.014,20]docosane-5,12,17-trione	162918695	Click to see CC1(C2CC(=O)C3(C(C24COC(=O)CC4O1)CCC5(C36C(O6)C(=O)OC5C7=COC=C7)C)C)C	470.50	unknown	https://doi.org/10.1248/CPB.49.649
[(1R,2R,4S,7R,8S,11R,12R,13S,18R)-7-[(2S)-2-hydroxy-5-oxo-2H-furan-4-yl]-1,8,12,17,17-pentamethyl-5,15,20-trioxo-3,6,16-trioxapentacyclo[9.9.0.02,4.02,8.012,18]icosan-13-yl] acetate	162979758	Click to see CC(=O)OC1CC(=O)OC(C2C1(C3CCC4(C(OC(=O)C5C4(C3(C(=O)C2)C)O5)C6=CC(OC6=O)O)C)C)(C)C	546.60	unknown	https://doi.org/10.1248/CPB.58.61
[(1R,2R,4S,7S,8S,11R,12R,18R)-7-(furan-3-yl)-1,8,12,17,17-pentamethyl-5,15,20-trioxo-3,6,16-trioxapentacyclo[9.9.0.02,4.02,8.012,18]icosan-13-yl] acetate	46783795	Click to see CC(=O)OC1CC(=O)OC(C2C1(C3CCC4(C(OC(=O)C5C4(C3(C(=O)C2)C)O5)C6=COC=C6)C)C)(C)C	514.60	unknown	via CMAUP database
[(1R,2R,8S,11S,12R,18S)-7-(furan-3-yl)-1,8,12,17,17-pentamethyl-5,15,20-trioxo-3,6,16-trioxapentacyclo[9.9.0.02,4.02,8.012,18]icosan-13-yl] acetate	137706495	Click to see CC(=O)OC1CC(=O)OC(C2C1(C3CCC4(C(OC(=O)C5C4(C3(C(=O)C2)C)O5)C6=COC=C6)C)C)(C)C	514.60	unknown	https://doi.org/10.2503/JJSHS.58.227
[7-(2-hydroxy-5-oxo-2H-furan-4-yl)-1,8,12,17,17-pentamethyl-5,15,20-trioxo-3,6,16-trioxapentacyclo[9.9.0.02,4.02,8.012,18]icosan-13-yl] acetate	162979757	Click to see CC(=O)OC1CC(=O)OC(C2C1(C3CCC4(C(OC(=O)C5C4(C3(C(=O)C2)C)O5)C6=CC(OC6=O)O)C)C)(C)C	546.60	unknown	https://doi.org/10.1248/CPB.58.61
1-(Acetyloxy)-1,2-dihydroobacunoic acid epsilon-lactone	6710776	Click to see CC(=O)OC1CC(=O)OC(C2C1(C3CCC4(C(OC(=O)C5C4(C3(C(=O)C2)C)O5)C6=COC=C6)C)C)(C)C	514.60	unknown	via CMAUP database
1-(Acetyloxy)-1,2-dihydroobacunoic acid eta-lactone	326240	Click to see CC(=O)OC1CC(=O)OC(C2C1(C3CCC4(C(OC(=O)C5C4(C3(C(=O)C2)C)O5)C6=COC=C6)C)C)(C)C	514.60	unknown	https://doi.org/10.2503/JJSHS.58.227 https://doi.org/10.1248/CPB.58.61 https://doi.org/10.3987/COM-08-11630
13-hydroxy-7-(2-hydroxy-5-oxo-2H-furan-4-yl)-1,8,12,17,17-pentamethyl-3,6,16-trioxapentacyclo[9.9.0.02,4.02,8.012,18]icosane-5,15,20-trione	73236888	Click to see CC1(C2CC(=O)C3(C(C2(C(CC(=O)O1)O)C)CCC4(C35C(O5)C(=O)OC4C6=CC(OC6=O)O)C)C)C	504.50	unknown	https://doi.org/10.1021/NP060217S
7-(2-hydroxy-5-oxo-2H-furan-3-yl)-1,8,12,17,17-pentamethyl-3,6,16-trioxapentacyclo[9.9.0.02,4.02,8.012,18]icos-13-ene-5,15,20-trione	14459786	Click to see CC1(C2CC(=O)C3(C(C2(C=CC(=O)O1)C)CCC4(C35C(O5)C(=O)OC4C6=CC(=O)OC6O)C)C)C	486.50	unknown	https://doi.org/10.1248/CPB.49.649
CID 12313416	12313416	Click to see CC(=O)OC1CC(=O)OC(C2C1(C3CCC4(C(OC(=O)C5C4(C3(C(=O)C2)C)O5)C6=COC=C6)C)C)(C)C	514.60	unknown	via CMAUP database
Deacetylnomilin	139082180	Click to see CC1(C2CC(=O)C3(C(C2(C(CC(=O)O1)O)C)CCC4(C35C(O5)C(=O)OC4C6=COC=C6)C)C)C	472.50	unknown	https://doi.org/10.2503/JJSHS.58.227
Evodia fruit	235284	Click to see CC1(C2CC(=O)C3(C(C24COC(=O)CC4O1)CCC5(C36C(O6)C(=O)OC5C7=COC=C7)C)C)C	470.50	unknown	https://doi.org/10.1021/JF104498P https://doi.org/10.1248/CPB.58.61 https://doi.org/10.1021/NP060217S https://doi.org/10.3987/COM-08-11630
Isoobacunoic acid	20055680	Click to see CC1(C2CC(=O)C3(C(C2(C(O1)CC(=O)O)C)CCC4(C35C(O5)C(=O)OC4C6=COC=C6)C)C)C	472.50	unknown	https://doi.org/10.1021/NP060217S https://doi.org/10.1248/CPB.49.649
Limonin	179651	Click to see CC1(C2CC(=O)C3(C(C24COC(=O)CC4O1)CCC5(C36C(O6)C(=O)OC5C7=COC=C7)C)C)C	470.50	unknown	https://doi.org/10.1248/CPB.58.61 https://doi.org/10.2503/JJSHS.58.227 https://doi.org/10.1248/CPB.49.649 https://doi.org/10.1021/NP060217S https://doi.org/10.1021/JF104498P https://doi.org/10.3987/COM-08-11630
Limonin 17-beta-D-glucopyranoside	24820753	Click to see CC1(C2CC(=O)C3(C(C24COC(=O)CC4O1)CCC(C35C(O5)C(=O)O)(C)C(C6=COC=C6)OC7C(C(C(C(O7)CO)O)O)O)C)C	650.70	unknown	https://doi.org/10.1016/0031-9422(91)85118-J
Nomilin	72320	Click to see CC(=O)OC1CC(=O)OC(C2C1(C3CCC4(C(OC(=O)C5C4(C3(C(=O)C2)C)O5)C6=COC=C6)C)C)(C)C	514.60	unknown	https://doi.org/10.3987/COM-08-11630 https://doi.org/10.1248/CPB.58.61
Nomilin glucoside	3083017	Click to see CC(=O)OC1CC(=O)OC(C2C1(C3CCC(C4(C3(C(=O)C2)C)C(O4)C(=O)O)(C)C(C5=COC=C5)OC6C(C(C(C(O6)CO)O)O)O)C)(C)C	694.70	unknown	https://doi.org/10.1016/0031-9422(91)85118-J
Obacunone	119041	Click to see CC1(C2CC(=O)C3(C(C2(C=CC(=O)O1)C)CCC4(C35C(O5)C(=O)OC4C6=COC=C6)C)C)C	454.50	unknown	https://doi.org/10.2503/JJSHS.58.227 https://doi.org/10.1248/CPB.49.649
> Lipids and lipid-like molecules / Saccharolipids
Nomilinic acid glycoside	20834260	Click to see CC(=O)OC(CC(=O)O)C1(C2CCC(C3(C2(C(=O)CC1C(C)(C)O)C)C(O3)C(=O)O)(C)C(C4=COC=C4)OC5C(C(C(C(O5)CO)O)O)O)C	712.70	unknown	https://doi.org/10.1016/0031-9422(91)85118-J
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Bile acids, alcohols and derivatives / Hydroxy bile acids, alcohols and derivatives
20-Hydroxyecdysone	5459840	Click to see CC12CCC3C(=CC(=O)C4C3(CC(C(C4)O)O)C)C1(CCC2C(C)(C(CCC(C)(C)O)O)O)O	480.60	unknown	via CMAUP database
3alpha-Hydroxyecdysone	70686927	Click to see CC12CCC3C(=CC(=O)C4C3(CC(C(C4)O)O)C)C1(CCC2C(C)(C(CCC(C)(C)O)O)O)O	480.60	unknown	via CMAUP database
Pterosterone	441836	Click to see CC(C)C(CC(C(C)(C1CCC2(C1(CCC3C2=CC(=O)C4C3(CC(C(C4)O)O)C)C)O)O)O)O	480.60	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Bile acids, alcohols and derivatives / Hydroxy bile acids, alcohols and derivatives / Pentahydroxy bile acids, alcohols and derivatives
3-Epiecdysone	23724769	Click to see CC(C1CCC2(C1(CCC3C2=CC(=O)C4C3(CC(C(C4)O)O)C)C)O)C(CCC(C)(C)O)O	464.60	unknown	via CMAUP database
Ecdysone	19212	Click to see CC(C1CCC2(C1(CCC3C2=CC(=O)C4C3(CC(C(C4)O)O)C)C)O)C(CCC(C)(C)O)O	464.60	unknown	via CMAUP database
Ponasterone A	115127	Click to see CC(C)CCC(C(C)(C1CCC2(C1(CCC3C2=CC(=O)C4C3(CC(C(C4)O)O)C)C)O)O)O	464.60	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Cholestane steroids / Cholesterols and derivatives
Cholesterol	5997	Click to see CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C	386.70	unknown	https://doi.org/10.1016/S0031-9422(00)83075-7
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Ergostane steroids / Ergosterols and derivatives
(3S,8S,9S,14S,17R)-17-[(2R,5R)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol	134766514	Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C	400.70	unknown	https://doi.org/10.1016/S0031-9422(00)83075-7
5-Cholestene-3-ol, 24-methyl-	312822	Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C	400.70	unknown	https://doi.org/10.1016/S0031-9422(00)83075-7
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroid lactones
(1R,2R,4S,7R,8S,11R,12R,13S,16R)-13-hydroxy-7-(2-hydroxy-5-oxo-2H-furan-4-yl)-1,8,12,13,15,15-hexamethyl-3,6,14-trioxapentacyclo[9.7.0.02,4.02,8.012,16]octadecane-5,18-dione	101718896	Click to see CC1(C2CC(=O)C3(C(C2(C(O1)(C)O)C)CCC4(C35C(O5)C(=O)OC4C6=CC(OC6=O)O)C)C)C	476.50	unknown	https://doi.org/10.1248/CPB.49.649
(1R,2R,4S,7R,8S,11R,12R,13S,16R)-13-hydroxy-7-[(2R)-2-hydroxy-5-oxo-2H-furan-4-yl]-1,8,12,13,15,15-hexamethyl-3,6,14-trioxapentacyclo[9.7.0.02,4.02,8.012,16]octadecane-5,18-dione	162995213	Click to see CC1(C2CC(=O)C3(C(C2(C(O1)(C)O)C)CCC4(C35C(O5)C(=O)OC4C6=CC(OC6=O)O)C)C)C	476.50	unknown	https://doi.org/10.1248/CPB.49.649
(1R,2R,4S,7R,8S,11R,12R,13S,16R)-7-(2-hydroxy-5-oxo-2H-furan-4-yl)-13-methoxy-1,8,12,13,15,15-hexamethyl-3,6,14-trioxapentacyclo[9.7.0.02,4.02,8.012,16]octadecane-5,18-dione	101718895	Click to see CC1(C2CC(=O)C3(C(C2(C(O1)(C)OC)C)CCC4(C35C(O5)C(=O)OC4C6=CC(OC6=O)O)C)C)C	490.50	unknown	https://doi.org/10.1248/CPB.49.649
(1R,2R,4S,7R,8S,11R,12R,13S,16R)-7-[(2R)-2-hydroxy-5-oxo-2H-furan-4-yl]-13-methoxy-1,8,12,13,15,15-hexamethyl-3,6,14-trioxapentacyclo[9.7.0.02,4.02,8.012,16]octadecane-5,18-dione	162916750	Click to see CC1(C2CC(=O)C3(C(C2(C(O1)(C)OC)C)CCC4(C35C(O5)C(=O)OC4C6=CC(OC6=O)O)C)C)C	490.50	unknown	https://doi.org/10.1248/CPB.49.649
(1R,2R,4S,7S,8S,11R,12R,13S,16R)-7-(furan-3-yl)-13-hydroxy-1,8,12,13,15,15-hexamethyl-3,6,14-trioxapentacyclo[9.7.0.02,4.02,8.012,16]octadecane-5,18-dione	101592373	Click to see CC1(C2CC(=O)C3(C(C2(C(O1)(C)O)C)CCC4(C35C(O5)C(=O)OC4C6=COC=C6)C)C)C	444.50	unknown	https://doi.org/10.1248/CPB.49.649 https://doi.org/10.2503/JJSHS.58.227
(1R,2R,7S,10R,13R,14R,16S,19R,20S)-19-[(2R)-2-hydroxy-5-oxo-2H-furan-4-yl]-9,9,13,20-tetramethyl-4,8,15,18-tetraoxahexacyclo[11.9.0.02,7.02,10.014,16.014,20]docosane-5,12,17-trione	124577341	Click to see CC1(C2CC(=O)C3(C(C24COC(=O)CC4O1)CCC5(C36C(O6)C(=O)OC5C7=CC(OC7=O)O)C)C)C	502.50	unknown	https://doi.org/10.1248/CPB.58.61
(1R,2R,7S,10R,13S,14R,20S)-19-(furan-3-yl)-12-hydroxy-9,9,13,20-tetramethyl-4,8,15,18-tetraoxahexacyclo[11.9.0.02,7.02,10.014,16.014,20]docosane-5,17-dione	138113953	Click to see CC1(C2CC(C3(C(C24COC(=O)CC4O1)CCC5(C36C(O6)C(=O)OC5C7=COC=C7)C)C)O)C	472.50	unknown	https://doi.org/10.1007/BF00518800
(2E)-3-[(3aS,5aR,6R,7R,9aR,9bR,10aS)-3-(Furan-3-yl)-7-(2-hydroxypropan-2-yl)-3a,6,9a-trimethyl-1,9-dioxododecahydronaphtho[2,1-c]oxireno[d]pyran-6-yl]prop-2-enoic acid	54611038	Click to see CC12CCC3C(C(CC(=O)C3(C14C(O4)C(=O)OC2C5=COC=C5)C)C(C)(C)O)(C)C=CC(=O)O	472.50	unknown	via CMAUP database
(3R)-3-acetyloxy-3-[(1R,2R,5R,6S,7R,10S,11S,14S)-11-(furan-3-yl)-5-(2-hydroxypropan-2-yl)-2,6,10-trimethyl-3,13-dioxo-12,15-dioxatetracyclo[8.5.0.01,14.02,7]pentadecan-6-yl]propanoic acid	162978918	Click to see CC(=O)OC(CC(=O)O)C1(C2CCC3(C(OC(=O)C4C3(C2(C(=O)CC1C(C)(C)O)C)O4)C5=COC=C5)C)C	532.60	unknown	https://doi.org/10.1021/NP060217S
(3S)-3-acetyloxy-3-[(1R,2R,5R,6R,7R,10S,11S,14S)-11-(furan-3-yl)-5-(2-hydroxypropan-2-yl)-2,6,10-trimethyl-3,13-dioxo-12,15-dioxatetracyclo[8.5.0.01,14.02,7]pentadecan-6-yl]propanoic acid	124708033	Click to see CC(=O)OC(CC(=O)O)C1(C2CCC3(C(OC(=O)C4C3(C2(C(=O)CC1C(C)(C)O)C)O4)C5=COC=C5)C)C	532.60	unknown	https://doi.org/10.1021/NP060217S
(E)-3-[(1R,2R,5R,6S,7R,10S,11S,14S)-11-(furan-3-yl)-5-(2-hydroxypropan-2-yl)-2,6,10-trimethyl-3,13-dioxo-12,15-dioxatetracyclo[8.5.0.01,14.02,7]pentadecan-6-yl]prop-2-enoic acid	162953869	Click to see CC12CCC3C(C(CC(=O)C3(C14C(O4)C(=O)OC2C5=COC=C5)C)C(C)(C)O)(C)C=CC(=O)O	472.50	unknown	https://doi.org/10.1248/CPB.49.649
19-(2-hydroxy-5-oxo-2H-furan-4-yl)-9,9,13,20-tetramethyl-4,8,15,18-tetraoxahexacyclo[11.9.0.02,7.02,10.014,16.014,20]docosane-5,12,17-trione	13996851	Click to see CC1(C2CC(=O)C3(C(C24COC(=O)CC4O1)CCC5(C36C(O6)C(=O)OC5C7=CC(OC7=O)O)C)C)C	502.50	unknown	https://doi.org/10.1248/CPB.58.61
2-[7-(Furan-3-yl)-1,8,12,15,15-pentamethyl-5,18-dioxo-3,6,14-trioxapentacyclo[9.7.0.02,4.02,8.012,16]octadecan-13-yl]acetic acid	12309587	Click to see CC1(C2CC(=O)C3(C(C2(C(O1)CC(=O)O)C)CCC4(C35C(O5)C(=O)OC4C6=COC=C6)C)C)C	472.50	unknown	https://doi.org/10.1021/NP060217S
3-[(1R,2R,5R,6R,7R,10S,11S,14S)-11-(furan-3-yl)-5-(2-hydroxypropan-2-yl)-2,6,10-trimethyl-3,13-dioxo-12,15-dioxatetracyclo[8.5.0.01,14.02,7]pentadecan-6-yl]-3-hydroxypropanoic acid	101601415	Click to see CC12CCC3C(C(CC(=O)C3(C14C(O4)C(=O)OC2C5=COC=C5)C)C(C)(C)O)(C)C(CC(=O)O)O	490.50	unknown	https://doi.org/10.2503/JJSHS.58.227
methyl (3R)-3-[(1S,2S,5R,6R,7R,10S,11S,14R)-11-(furan-3-yl)-5-(2-hydroxypropan-2-yl)-2,6,10-trimethyl-3,13-dioxo-12,15-dioxatetracyclo[8.5.0.01,14.02,7]pentadecan-6-yl]-3-hydroxypropanoate	163072442	Click to see CC12CCC3C(C(CC(=O)C3(C14C(O4)C(=O)OC2C5=COC=C5)C)C(C)(C)O)(C)C(CC(=O)OC)O	504.60	unknown	https://doi.org/10.1021/NP060217S
methyl (3S)-3-acetyloxy-3-[(1R,2R,5R,6R,7R,10S,11R,14S)-11-[(2S)-2-hydroxy-5-oxo-2H-furan-4-yl]-5-(2-hydroxypropan-2-yl)-2,6,10-trimethyl-3,13-dioxo-12,15-dioxatetracyclo[8.5.0.01,14.02,7]pentadecan-6-yl]propanoate	162847478	Click to see CC(=O)OC(CC(=O)OC)C1(C2CCC3(C(OC(=O)C4C3(C2(C(=O)CC1C(C)(C)O)C)O4)C5=CC(OC5=O)O)C)C	578.60	unknown	https://doi.org/10.1021/NP060217S
Methyl 3-[11-(furan-3-yl)-5-(2-hydroxypropan-2-yl)-2,6,10-trimethyl-3,13-dioxo-12,15-dioxatetracyclo[8.5.0.01,14.02,7]pentadecan-6-yl]-3-hydroxypropanoate	14037479	Click to see CC12CCC3C(C(CC(=O)C3(C14C(O4)C(=O)OC2C5=COC=C5)C)C(C)(C)O)(C)C(CC(=O)OC)O	504.60	unknown	https://doi.org/10.1021/NP060217S
methyl 3-acetyloxy-3-[11-(2-hydroxy-5-oxo-2H-furan-4-yl)-5-(2-hydroxypropan-2-yl)-2,6,10-trimethyl-3,13-dioxo-12,15-dioxatetracyclo[8.5.0.01,14.02,7]pentadecan-6-yl]propanoate	73236891	Click to see CC(=O)OC(CC(=O)OC)C1(C2CCC3(C(OC(=O)C4C3(C2(C(=O)CC1C(C)(C)O)C)O4)C5=CC(OC5=O)O)C)C	578.60	unknown	https://doi.org/10.1021/NP060217S
Nomilinic acid	131751863	Click to see CC(=O)OC(CC(=O)O)C1(C2CCC3(C(OC(=O)C4C3(C2(C(=O)CC1C(C)(C)O)C)O4)C5=COC=C5)C)C	532.60	unknown	https://doi.org/10.2503/JJSHS.58.227 https://doi.org/10.1007/BF00518800 https://doi.org/10.1021/NP060217S
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal glycosides
17-[1-[5'-[5-[4-Hydroxy-5-[5-(5-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy-4-methoxy-6-methyloxan-2-yl]oxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-4'-methoxy-6',9-dimethylspiro[4,5a,6,7,9,9a-hexahydropyrano[3,4-c][1,2,5]trioxepine-3,2'-oxane]-7-yl]oxyethyl]-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,17-diol	74397825	Click to see CC1C(C(CC(O1)OC2C(OC(CC2OC)OC3C(OC(CC3O)OC4C(OC(CC4OC)OC5C(OC6(CC5OC)COC7CC(OC(C7OO6)C)OC(C)C8(CCC9C8(CCC1C9CC=C2C1(CCC(C2)O)C)C)O)C)C)C)C)OC)O	1199.50	unknown	https://doi.org/10.1021/NP060217S
Ponasteroside A	12314455	Click to see CC(C)CCC(C(C)(C1CCC2(C1(CCC3C2=CC(=O)C4C3(CC(C(C4)OC5C(C(C(C(O5)CO)O)O)O)O)C)C)O)O)O	626.80	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
(3R,4S,5S,6R)-2-[[(3S,8S,9S,10R,13R,14S)-17-[(2R,5R)-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-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol	52940117	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	via CMAUP database
(3S,4S,5S,10S,13R)-4,10,13-trimethyl-17-[(Z,2R)-5-propan-2-ylhept-5-en-2-yl]-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol	25245448	Click to see CC=C(CCC(C)C1CCC2C1(CCC3C2=CCC4C3(CCC(C4C)O)C)C)C(C)C	426.70	unknown	via CMAUP database
17-(5-ethyl-6-methylhept-3-en-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol	122544	Click to see CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	412.70	unknown	https://doi.org/10.3987/COM-08-11630
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/10.3987/COM-99-8782 https://doi.org/10.1016/S0031-9422(00)83075-7 https://doi.org/10.3987/COM-08-11630
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/10.3987/COM-99-8782 https://doi.org/10.1016/S0031-9422(00)83075-7
Beta-Sitosterol	222284	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	414.70	unknown	https://doi.org/10.3987/COM-99-8782 https://doi.org/10.3987/COM-08-11630
Stigmast-4-en-3-one	5484202	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C)C(C)C	412.70	unknown	via CMAUP database
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/10.3987/COM-08-11630 https://doi.org/10.1016/S0031-9422(00)83075-7
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Peptides / Cyclic peptides
Citrusin III	85632473	Click to see CC(C)CC1C(=O)NC(C(=O)N2CCCC2C(=O)NC(C(=O)NCC(=O)NC(C(=O)N3CCCC3C(=O)N1)CO)CC4=CC=C(C=C4)O)CC(C)C	727.80	unknown	https://doi.org/10.1021/NP060217S
cyclo[DL-Glu-DL-xiIle-Gly-DL-xiIle-DL-Phe-DL-Pro-DL-Pro]	162877462	Click to see CCC(C)C1C(=O)NC(C(=O)N2CCCC2C(=O)N3CCCC3C(=O)NC(C(=O)NC(C(=O)NCC(=O)N1)C(C)CC)CCC(=O)O)CC4=CC=CC=C4	753.90	unknown	https://doi.org/10.1021/NP060217S
cyclo[Glu-Ile-Gly-Ile-Phe-Pro-Pro]	162877463	Click to see CCC(C)C1C(=O)NC(C(=O)N2CCCC2C(=O)N3CCCC3C(=O)NC(C(=O)NC(C(=O)NCC(=O)N1)C(C)CC)CCC(=O)O)CC4=CC=CC=C4	753.90	unknown	https://doi.org/10.1021/NP060217S
cyclo[Gly-Ser-Pro-Leu-Leu-Pro-Tyr]	162883031	Click to see CC(C)CC1C(=O)NC(C(=O)N2CCCC2C(=O)NC(C(=O)NCC(=O)NC(C(=O)N3CCCC3C(=O)N1)CO)CC4=CC=C(C=C4)O)CC(C)C	727.80	unknown	https://doi.org/10.1021/NP060217S
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Peptides / Oligopeptides
cyclo(-Gly-Leu-Pro-Trp-Leu-Ile-Ala-Ala-)	11136586	Click to see CCC(C)C1C(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)N2CCCC2C(=O)NC(C(=O)NC(C(=O)N1)CC(C)C)CC3=CNC4=CC=CC=C43)CC(C)C)C)C	822.00	unknown	https://doi.org/10.1248/CPB.50.857
S-hexahydroxydiphenoyl-beta-D-glucose	85411966	Click to see CCC(C)C1C(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)N2CCCC2C(=O)NC(C(=O)NC(C(=O)N1)CC(C)C)CC3=CNC4=CC=CC=C43)CC(C)C)C)C	822.00	unknown	https://doi.org/10.1248/CPB.50.857
> Organic acids and derivatives / Carboxylic acids and derivatives / Carboxylic acid derivatives / Carboxylic acid esters
3,7-Dimethyloct-1-en-3-yl acetate	109318	Click to see CC(C)CCCC(C)(C=C)OC(=O)C	198.30	unknown	via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Carboxylic acid derivatives / Carboxylic acid esters / Enol esters
3,7-Dimethyl-trans-2,6-octadien-1-yl acetate	24832062	Click to see CC(=CCCC(=COC(=O)C)C)C	182.26	unknown	via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Dicarboxylic acids and derivatives
(E)-but-2-enedioate;hydron	21883788	Click to see [H+].[H+].C(=CC(=O)[O-])C(=O)[O-]	116.07	unknown	via CMAUP database
Butanedioate;hydron	21952380	Click to see [H+].[H+].C(CC(=O)[O-])C(=O)[O-]	118.09	unknown	via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Tricarboxylic acids and derivatives
2-(Carboxymethyl)-2-hydroxybutanedioate;hydron	88113319	Click to see [H+].[H+].C(C(=O)O)C(CC(=O)[O-])(C(=O)[O-])O	192.12	unknown	via CMAUP database
> Organic acids and derivatives / Hydroxy acids and derivatives / Beta hydroxy acids and derivatives
Hydron;2-hydroxybutanedioate	20130941	Click to see [H+].[H+].C(C(C(=O)[O-])O)C(=O)[O-]	134.09	unknown	via CMAUP database
> Organic acids and derivatives / Peptidomimetics / Hybrid peptides
cyclo[Asp-Leu-aThr-Val-Tyr-Phe-Gly]	163194004	Click to see CC(C)CC1C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)N1)CC(=O)O)CC2=CC=CC=C2)CC3=CC=C(C=C3)O)C(C)C)C(C)O	795.90	unknown	https://doi.org/10.1248/CPB.50.857
cyclo[DL-Asp-DL-Leu-DL-xiThr-DL-Val-DL-Tyr-DL-Phe-Gly]	162972929	Click to see CC(C)CC1C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)N1)CC(=O)O)CC2=CC=CC=C2)CC3=CC=C(C=C3)O)C(C)C)C(C)O	795.90	unknown	https://doi.org/10.1248/CPB.50.857
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Quinic acids and derivatives
3-O-p-Coumaroylquinic acid	14158103	Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC=C(C=C2)O)O)O	338.31	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
trans-5-O-(4-coumaroyl)-D-quinic acid	6441280	Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC=C(C=C2)O)O)O	338.31	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Cyanogenic glycosides
Prunasin	119033	Click to see C1=CC=C(C=C1)C(C#N)OC2C(C(C(C(O2)CO)O)O)O	295.29	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds
(2S,3R)-3-hydroxy-2,5,7-trimethyl-6-[2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]-2,3-dihydroinden-1-one	46848577	Click to see CC1C(C2=C(C1=O)C(=C(C(=C2)C)CCOC3C(C(C(C(O3)CO)O)O)O)C)O	396.40	unknown	via CMAUP database
(2S,3S)-6-(2-hydroxyethyl)-2,5,7-trimethyl-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydroinden-1-one	23260007	Click to see CC1C(C2=C(C1=O)C(=C(C(=C2)C)CCO)C)OC3C(C(C(C(O3)CO)O)O)O	396.40	unknown	via CMAUP database
(2S)-2,5,7-trimethyl-6-[2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]-2,3-dihydroinden-1-one	46848576	Click to see CC1CC2=C(C1=O)C(=C(C(=C2)C)CCOC3C(C(C(C(O3)CO)O)O)O)C	380.40	unknown	via CMAUP database
(3R)-6-(2-hydroxyethyl)-2,2,5,7-tetramethyl-3-[(2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3H-inden-1-one	46848743	Click to see CC1=CC2=C(C(=C1CCO)C)C(=O)C(C2OC3C(C(C(C(O3)CO)O)O)O)(C)C	410.50	unknown	via CMAUP database
Ptaquiloside	13962857	Click to see CC1CC2(C=C(C3(CC3)C(C2C1=O)(C)O)C)OC4C(C(C(C(O4)CO)O)O)O	398.40	unknown	via CMAUP database
Pteroside A	169727	Click to see CC1=CC2=C(C(=C1CCOC3C(C(C(C(O3)CO)O)O)O)C)C(=O)C(C2)(C)CO	410.50	unknown	via CMAUP database
Pteroside B	134279	Click to see CC1CC2=C(C1=O)C(=C(C(=C2)C)CCOC3C(C(C(C(O3)CO)O)O)O)C	380.40	unknown	via CMAUP database
Pteroside C	169728	Click to see CC1C(C2=C(C1=O)C(=C(C(=C2)C)CCOC3C(C(C(C(O3)CO)O)O)O)C)O	396.40	unknown	via CMAUP database
Pteroside D	169738	Click to see CC1=CC2=C(C(=C1CCOC3C(C(C(C(O3)CO)O)O)O)C)C(=O)C(C2O)(C)C	410.50	unknown	via CMAUP database
Pteroside P	148715	Click to see CC1CC2=CC(=C(C(=C2C1=O)C)CCOC3C(C(C(C(O3)CO)O)O)O)CO	396.40	unknown	via CMAUP database
Pteroside Z	169737	Click to see CC1=CC2=C(C(=C1CCOC3C(C(C(C(O3)CO)O)O)O)C)C(=O)C(C2)(C)C	394.50	unknown	via CMAUP database
pterosin C 3-O-glucoside	44201982	Click to see CC1C(C2=C(C1=O)C(=C(C(=C2)C)CCOC3C(C(C(C(O3)CO)O)O)O)C)O	396.40	unknown	via CMAUP database
Pterosin D 3-O-glucoside	21670079	Click to see CC1=CC2=C(C(=C1CCO)C)C(=O)C(C2OC3C(C(C(C(O3)CO)O)O)O)(C)C	410.50	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides
4-Ethenylphenyl beta-D-glucopyranoside	182338	Click to see C=CC1=CC=C(C=C1)OC2C(C(C(C(O2)CO)O)O)O	282.29	unknown	via CMAUP database
beta-D-Glucopyranoside, 4-ethenylphenyl 6-O-beta-D-xylopyranosyl-	185053	Click to see C=CC1=CC=C(C=C1)OC2C(C(C(C(O2)COC3C(C(C(CO3)O)O)O)O)O)O	414.40	unknown	via CMAUP database
Ptelatoside b	130179	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC=C(C=C3)C=C)CO)O)O)O)O)O	428.40	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Medium-chain aldehydes
Decanal	8175	Click to see CCCCCCCCCC=O	156.26	unknown	via CMAUP database
Dodecanal	8194	Click to see CCCCCCCCCCCC=O	184.32	unknown	via CMAUP database
Nonanal	31289	Click to see CCCCCCCCC=O	142.24	unknown	https://doi.org/10.1080/10412905.1996.9700547
Octanal	454	Click to see CCCCCCCC=O	128.21	unknown	via CMAUP database
Undecanal	8186	Click to see CCCCCCCCCCC=O	170.29	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones
2-Undecanone	8163	Click to see CCCCCCCCCC(=O)C	170.29	unknown	https://doi.org/10.1080/10412905.1996.9700547
6-Methyl-5-hepten-2-one	9862	Click to see CC(=CCCC(=O)C)C	126.20	unknown	https://doi.org/10.1080/10412905.1996.9700547
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Phenylketones / Alkyl-phenylketones
4'-Methylacetophenone	8500	Click to see CC1=CC=C(C=C1)C(=O)C	134.17	unknown	https://doi.org/10.1080/10412905.1996.9700547
> Organoheterocyclic compounds / Benzofurans
Cryptocaryone	10379026	Click to see C1C2C(C=CC(=O)C2=C(C=CC3=CC=CC=C3)O)OC1=O	282.29	unknown	via CMAUP database
> Organoheterocyclic compounds / Coumarans
2,3-Dihydrobenzofuran	10329	Click to see C1COC2=CC=CC=C21	120.15	unknown	via CMAUP database
> Organoheterocyclic compounds / Isoquinolines and derivatives
6-Methyl-1,3-dioxolo[4,5-g]isoquinolin-6-ium	2753983	Click to see C[N+]1=CC2=CC3=C(C=C2C=C1)OCO3	188.20	unknown	via CMAUP database
> Organoheterocyclic compounds / Isoquinolines and derivatives / Benzylisoquinolines
4-(6,7-Dimethoxyisoquinoline-1-ylmethyl)phenol	21814573	Click to see COC1=C(C=C2C(=C1)C=CN=C2CC3=CC=C(C=C3)O)OC	295.30	unknown	via CMAUP database
4-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-[4-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]phenoxy]phenol	45358120	Click to see CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)OC4=C(C=CC(=C4)CC5C6=CC(=C(C=C6CCN5C)OC)OC)O)OC)OC	624.80	unknown	via CMAUP database
> Organoheterocyclic compounds / Isoquinolines and derivatives / Isoquinolones and derivatives
Doryanin	12998814	Click to see CN1C=CC2=CC3=C(C=C2C1=O)OCO3	203.19	unknown	via CMAUP database
> Organoheterocyclic compounds / Naphthofurans
9b-(2-Carboxy-1-hydroxyethyl)-7-[furan-3-yl(hydroxy)methyl]-3,3,5a,7-tetramethyl-5-oxospiro[1,3a,4,8,9,9a-hexahydrobenzo[e][2]benzofuran-6,3'-oxirane]-2'-carboxylic acid	162818618	Click to see CC1(C2CC(=O)C3(C(C2(CO1)C(CC(=O)O)O)CCC(C34C(O4)C(=O)O)(C)C(C5=COC=C5)O)C)C	506.50	unknown	https://doi.org/10.2503/JJSHS.58.227
> Organoheterocyclic compounds / Naphthopyrans
(7alpha,10beta)-1(10->19)-Abeo-7-acetoxyisoobacun-3,10-olide	131751661	Click to see CC(=O)OC1CC2C(OC3CC(=O)OC2(C3)C4C1(C56C(O5)C(=O)OC(C6(CC4)C)C7=COC=C7)C)(C)C	514.60	unknown	https://doi.org/10.1248/CPB.58.61
[(1S,2S,5S,6S,9S,11R,12S,13R,15S,18R)-6-(furan-3-yl)-5,12,16,16-tetramethyl-8,20-dioxo-7,10,17,21-tetraoxahexacyclo[16.3.1.01,15.02,12.05,11.09,11]docosan-13-yl] acetate	162891866	Click to see CC(=O)OC1CC2C(OC3CC(=O)OC2(C3)C4C1(C56C(O5)C(=O)OC(C6(CC4)C)C7=COC=C7)C)(C)C	514.60	unknown	https://doi.org/10.1248/CPB.58.61
> Organoheterocyclic compounds / Oxepanes
(+)-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
Limonene oxide, trans-(-)-	8029780	Click to see CC(=C)C1CCC2(C(C1)O2)C	152.23	unknown	via CMAUP database
> Organoheterocyclic compounds / Pyrans / Pyranones and derivatives / Dihydropyranones
4H-Pyran-4-one, 2,3-dihydro-3,5-dihydroxy-6-methyl-	119838	Click to see CC1=C(C(=O)C(CO1)O)O	144.12	unknown	via CMAUP database
Cryptocaryanone A	10356404	Click to see C1C2C(C=CC3=C2C(=O)CC(O3)C4=CC=CC=C4)OC1=O	282.29	unknown	via CMAUP database
Cryptochinone A	46939683	Click to see C1C2C(C(CC3=C2C(=O)CC(O3)C4=CC=CC=C4)O)OC1=O	300.30	unknown	via CMAUP database
Cryptochinone B	46939684	Click to see C1C2C(C(CC3=C2C(=O)CC(O3)C4=CC=CC=C4)O)OC1=O	300.30	unknown	via CMAUP database
Cryptochinone C	46939685	Click to see COC1CC2=C(C3C1OC(=O)C3)C(=O)CC(O2)C4=CC=CC=C4	314.30	unknown	via CMAUP database
Cryptochinone D	46939686	Click to see COC1CC2=C(C3C1OC(=O)C3)C(=O)CC(O2)C4=CC=CC=C4	314.30	unknown	via CMAUP database
> Organoheterocyclic compounds / Pyrrolidines / Pyrrolidones / Pyrrolidine-2-ones
(5R)-5-methoxypyrrolidin-2-one	643445	Click to see COC1CCC(=O)N1	115.13	unknown	via CMAUP database
> Organoheterocyclic compounds / Tetrahydroisoquinolines
Isocryprochine	10914050	Click to see CN1CCC2=CC(=C(C3=C2C1CC34CCC=CC4O)OC)OC	315.40	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives
[(2S,3R,4R)-4-hydroxy-2-[(1S)-1-hydroxy-2-methoxy-2-oxoethyl]-5-oxooxolan-3-yl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate	16083131	Click to see COC1=C(C=CC(=C1)C=CC(=O)OC2C(C(=O)OC2C(C(=O)OC)O)O)O	382.30	unknown	https://doi.org/10.1021/NP060217S
[4-Hydroxy-2-(1-hydroxy-2-methoxy-2-oxoethyl)-5-oxooxolan-3-yl] 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate	73236889	Click to see COC1=C(C=CC(=C1)C=CC(=O)OC2C(C(=O)OC2C(C(=O)OC)O)O)O	382.30	unknown	https://doi.org/10.1021/NP060217S
5-Caffeoylshikimic acid	5281762	Click to see C1C(C(C(C=C1C(=O)O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O	336.29	unknown	via CMAUP database
Hexacosyl (E)-ferulate	5318033	Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCOC(=O)C=CC1=CC(=C(C=C1)O)OC	558.90	unknown	via CMAUP database
Methyl 4-hydroxy-3-methoxy-cinnamate	16830	Click to see COC1=C(C=CC(=C1)C=CC(=O)OC)O	208.21	unknown	https://doi.org/10.1021/NP060217S
Methyl ferulate	5357283	Click to see COC1=C(C=CC(=C1)C=CC(=O)OC)O	208.21	unknown	https://doi.org/10.1021/NP060217S
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids
3-(4-Hydroxy-3-methoxyphenyl)prop-2-enoic acid	709	Click to see COC1=C(C=CC(=C1)C=CC(=O)O)O	194.18	unknown	https://doi.org/10.1021/NP060217S
4-Hydroxycinnamic acid	322	Click to see C1=CC(=CC=C1C=CC(=O)O)O	164.16	unknown	https://doi.org/10.1248/CPB.58.61 https://doi.org/10.3987/COM-08-11630
cis-p-Coumaric acid	1549106	Click to see C1=CC(=CC=C1C=CC(=O)O)O	164.16	unknown	https://doi.org/10.1248/CPB.58.61 https://doi.org/10.3987/COM-08-11630
Ferulic acid	445858	Click to see COC1=C(C=CC(=C1)C=CC(=O)O)O	194.18	unknown	https://doi.org/10.1021/NP060217S
> Phenylpropanoids and polyketides / Coumarins and derivatives
(R)-Marmin	5964600	Click to see CC(=CCOC1=CC2=C(C=C1)C=CC(=O)O2)CCC(C(C)(C)O)O	332.40	unknown	via CMAUP database
(R)-Meranzin	3819217	Click to see CC1(C(O1)CC2=C(C=CC3=C2OC(=O)C=C3)OC)C	260.28	unknown	via CMAUP database
3-(6,7-Dimethoxy-2-oxochromen-3-yl)-6,7-dimethoxychromen-2-one	102288068	Click to see COC1=C(C=C2C(=C1)C=C(C(=O)O2)C3=CC4=CC(=C(C=C4OC3=O)OC)OC)OC	410.40	unknown	https://doi.org/10.3987/COM-08-11630 https://doi.org/10.1248/CPB.58.61
5,6,7-Trimethoxycoumarin	148724	Click to see COC1=C(C(=C2C=CC(=O)OC2=C1)OC)OC	236.22	unknown	via CMAUP database
5,7-Dimethoxycoumarin	2775	Click to see COC1=CC2=C(C=CC(=O)O2)C(=C1)OC	206.19	unknown	https://doi.org/10.1248/CPB.58.61 https://doi.org/10.3987/COM-99-8782 https://doi.org/10.1039/CT8905700323 https://doi.org/10.3987/COM-08-11630
7-Methoxycoumarin	10748	Click to see COC1=CC2=C(C=C1)C=CC(=O)O2	176.17	unknown	https://doi.org/10.1248/CPB.58.61 https://doi.org/10.3987/COM-08-11630
7,8-Dimethoxycoumarin	142768	Click to see COC1=C(C2=C(C=C1)C=CC(=O)O2)OC	206.19	unknown	https://doi.org/10.3987/COM-08-11630 https://doi.org/10.1248/CPB.58.61 https://doi.org/10.3987/COM-99-8782
8-[(2S)-2,3-dihydroxy-3-methylbutyl]-7-methoxychromen-2-one	821434	Click to see CC(C)(C(CC1=C(C=CC2=C1OC(=O)C=C2)OC)O)O	278.30	unknown	via CMAUP database
Isomeranzin	473252	Click to see CC(C)C(=O)CC1=C(C=CC2=C1OC(=O)C=C2)OC	260.28	unknown	via CMAUP database
Marmin	6450230	Click to see CC(=CCOC1=CC2=C(C=C1)C=CC(=O)O2)CCC(C(C)(C)O)O	332.40	unknown	via CMAUP database
Meranzin	1803558	Click to see CC1(C(O1)CC2=C(C=CC3=C2OC(=O)C=C3)OC)C	260.28	unknown	via CMAUP database
Osthol	10228	Click to see CC(=CCC1=C(C=CC2=C1OC(=O)C=C2)OC)C	244.28	unknown	via CMAUP database
Scoparone	8417	Click to see COC1=C(C=C2C(=C1)C=CC(=O)O2)OC	206.19	unknown	https://doi.org/10.3987/COM-08-11630 https://doi.org/10.1248/CPB.58.61 https://doi.org/10.3987/COM-99-8782
> Phenylpropanoids and polyketides / Coumarins and derivatives / Furanocoumarins / Linear furanocoumarins
(1R,2S,14S,15R)-4,25-dimethoxy-8,12,17,21-tetraoxaheptacyclo[13.11.0.02,14.03,11.05,9.018,26.020,24]hexacosa-3(11),4,6,9,18(26),19,22,24-octaene-13,16-dione	11144530	Click to see COC1=C2C=COC2=CC3=C1C4C5C(C4C(=O)O3)C(=O)OC6=C5C(=C7C=COC7=C6)OC	432.40	unknown	https://doi.org/10.3987/COM-99-8782
4,25-Dimethoxy-8,12,17,21-tetraoxaheptacyclo[13.11.0.02,14.03,11.05,9.018,26.020,24]hexacosa-3(11),4,6,9,18(26),19,22,24-octaene-13,16-dione	85414491	Click to see COC1=C2C=COC2=CC3=C1C4C5C(C4C(=O)O3)C(=O)OC6=C5C(=C7C=COC7=C6)OC	432.40	unknown	https://doi.org/10.3987/COM-99-8782
> Phenylpropanoids and polyketides / Coumarins and derivatives / Furanocoumarins / Psoralens
(-)-Heraclenol	40429858	Click to see CC(C)(C(COC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2)O)O	304.29	unknown	https://doi.org/10.3987/COM-99-8782
(R)-(+)-Oxypeucedanin Hydrate	53319618	Click to see CC(C)(C(COC1=C2C=CC(=O)OC2=CC3=C1C=CO3)O)O.O	322.31	unknown	via CMAUP database
4-[(3,3-Dimethyloxiran-2-yl)methoxy]furo[3,2-g]chromen-7-one	160544	Click to see CC1(C(O1)COC2=C3C=CC(=O)OC3=CC4=C2C=CO4)C	286.28	unknown	via CMAUP database
5-[[(2S)-3,3-dimethyloxiran-2-yl]methoxy]furo[3,2-g]chromen-7-one	53316971	Click to see CC1(C(O1)COC2=CC(=O)OC3=C2C=C4C=COC4=C3)C	286.28	unknown	via CMAUP database
9-(2,3-Dihydroxy-3-methylbutoxy)furo[3,2-g]chromen-7-one	328236	Click to see CC(C)(C(COC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2)O)O	304.29	unknown	https://doi.org/10.3987/COM-99-8782
Heraclenol	73253	Click to see CC(C)(C(COC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2)O)O	304.29	unknown	https://doi.org/10.3987/COM-99-8782
Isoimperatorin	68081	Click to see CC(=CCOC1=C2C=CC(=O)OC2=CC3=C1C=CO3)C	270.28	unknown	via CMAUP database
Oxypeucedanin	928465	Click to see CC1(C(O1)COC2=C3C=CC(=O)OC3=CC4=C2C=CO4)C	286.28	unknown	via CMAUP database
Oxypeucedanin hydrate	17536	Click to see CC(C)(C(COC1=C2C=CC(=O)OC2=CC3=C1C=CO3)O)O	304.29	unknown	via CMAUP database
Oxypseucedanin	33306	Click to see CC1(C(O1)COC2=C3C=CC(=O)OC3=CC4=C2C=CO4)C	286.28	unknown	via CMAUP database
Pentosalen	10212	Click to see CC(=CCOC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2)C	270.28	unknown	via CMAUP database
Psoralen	6199	Click to see C1=CC(=O)OC2=CC3=C(C=CO3)C=C21	186.16	unknown	https://doi.org/10.3987/COM-99-8782
> Phenylpropanoids and polyketides / Coumarins and derivatives / Furanocoumarins / Psoralens / 5-hydroxypsoralens
Bergaptol	5280371	Click to see C1=CC(=O)OC2=CC3=C(C=CO3)C(=C21)O	202.16	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Coumarins and derivatives / Furanocoumarins / Psoralens / 5-methoxypsoralens
(Rac)-Byakangelicin	616063	Click to see CC(C)(C(COC1=C2C(=C(C3=C1OC(=O)C=C3)OC)C=CO2)O)O	334.30	unknown	https://doi.org/10.3987/COM-99-8782
8-Hydroxybergapten	3083726	Click to see COC1=C2C=COC2=C(C3=C1C=CC(=O)O3)O	232.19	unknown	via CMAUP database
Bergapten	2355	Click to see COC1=C2C=CC(=O)OC2=CC3=C1C=CO3	216.19	unknown	https://doi.org/10.3987/COM-99-8782
Byakangelicin	10211	Click to see CC(C)(C(COC1=C2C(=C(C3=C1OC(=O)C=C3)OC)C=CO2)O)O	334.30	unknown	https://doi.org/10.3987/COM-99-8782
Byakangelicol	3055167	Click to see CC1(C(O1)COC2=C3C(=C(C4=C2OC(=O)C=C4)OC)C=CO3)C	316.30	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Coumarins and derivatives / Furanocoumarins / Psoralens / 8-methoxypsoralens
Isopimpinellin	68079	Click to see COC1=C2C=COC2=C(C3=C1C=CC(=O)O3)OC	246.21	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins
Isoscopoletin	69894	Click to see COC1=C(C=C2C=CC(=O)OC2=C1)O	192.17	unknown	via CMAUP database
Leptodactylone	442134	Click to see COC1=CC(=C(C2=C1C=CC(=O)O2)O)OC	222.19	unknown	https://doi.org/10.3987/COM-08-11630 https://doi.org/10.1248/CPB.58.61
> Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins / 7-hydroxycoumarins
6-Formylumbelliferone	14213968	Click to see C1=CC(=O)OC2=CC(=C(C=C21)C=O)O	190.15	unknown	https://doi.org/10.1248/CPB.36.3805
7-Hydroxy-8-methoxycoumarin	5316302	Click to see COC1=C(C=CC2=C1OC(=O)C=C2)O	192.17	unknown	https://doi.org/10.3987/COM-99-8782
Demethylsuberosin	5316525	Click to see CC(=CCC1=C(C=C2C(=C1)C=CC(=O)O2)O)C	230.26	unknown	https://doi.org/10.1248/CPB.58.61
Osthenol	5320318	Click to see CC(=CCC1=C(C=CC2=C1OC(=O)C=C2)O)C	230.26	unknown	https://doi.org/10.1248/CPB.58.61
Scopoletin	5280460	Click to see COC1=C(C=C2C(=C1)C=CC(=O)O2)O	192.17	unknown	via CMAUP database
Umbelliferone	5281426	Click to see C1=CC(=CC2=C1C=CC(=O)O2)O	162.14	unknown	https://doi.org/10.3987/COM-99-8782
> Phenylpropanoids and polyketides / Coumarins and derivatives / Pyranocoumarins / Angular pyranocoumarins
(4R)-4,5,5,15,15-pentamethyl-10-(2-methylbut-3-en-2-yl)-3,8,14-trioxatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),7(12),10,16-pentaen-9-one	162862905	Click to see CC1C(C2=C(O1)C3=C(C4=C2OC(=O)C(=C4)C(C)(C)C=C)OC(C=C3)(C)C)(C)C	380.50	unknown	https://doi.org/10.1248/CPB.58.61
(4S)-4,5,5,15,15-pentamethyl-3,8,14-trioxatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),7(12),10,16-pentaen-9-one	162862706	Click to see CC1C(C2=C(O1)C3=C(C4=C2OC(=O)C=C4)OC(C=C3)(C)C)(C)C	312.40	unknown	https://doi.org/10.1248/CPB.58.61
4,5,5,15,15-Pentamethyl-10-(2-methylbut-3-en-2-yl)-3,8,14-trioxatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),7(12),10,16-pentaen-9-one	45101030	Click to see CC1C(C2=C(O1)C3=C(C4=C2OC(=O)C(=C4)C(C)(C)C=C)OC(C=C3)(C)C)(C)C	380.50	unknown	https://doi.org/10.1248/CPB.58.61
5-Methoxyseselin	290897	Click to see CC1(C=CC2=C3C(=C(C=C2O1)OC)C=CC(=O)O3)C	258.27	unknown	via CMAUP database
Citrusarin A	15108309	Click to see CC1C(C2=C(O1)C3=C(C4=C2OC(=O)C=C4)OC(C=C3)(C)C)(C)C	312.40	unknown	https://doi.org/10.1248/CPB.58.61
Nordentatin	5320206	Click to see CC1(C=CC2=C(O1)C3=C(C(=C2O)C(C)(C)C=C)OC(=O)C=C3)C	312.40	unknown	https://doi.org/10.3987/COM-08-11630
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 / Coumarins and derivatives / Pyranocoumarins / Linear pyranocoumarins
5-Hydroxy-2,2-dimethyl-10-[2-(oxiran-2-yl)propan-2-yl]pyrano[3,2-g]chromen-8-one	15101825	Click to see CC1(C=CC2=C(O1)C(=C3C(=C2O)C=CC(=O)O3)C(C)(C)C4CO4)C	328.40	unknown	https://doi.org/10.1248/CPB.58.61
5-hydroxy-2,2-dimethyl-10-[2-[(2S)-oxiran-2-yl]propan-2-yl]pyrano[3,2-g]chromen-8-one	162846631	Click to see CC1(C=CC2=C(O1)C(=C3C(=C2O)C=CC(=O)O3)C(C)(C)C4CO4)C	328.40	unknown	https://doi.org/10.1248/CPB.58.61
Clausarin	5315945	Click to see CC1(C=CC2=C(O1)C(=C3C(=C2O)C=C(C(=O)O3)C(C)(C)C=C)C(C)(C)C=C)C	380.50	unknown	https://doi.org/10.1248/CPB.58.61
nor-Dentatin	5495613	Click to see CC1(C=CC2=C(O1)C(=C3C(=C2O)C=CC(=O)O3)C(C)(C)C=C)C	312.40	unknown	https://doi.org/10.1248/CPB.58.61
Xanthoxyletin	66548	Click to see CC1(C=CC2=C(O1)C=C3C(=C2OC)C=CC(=O)O3)C	258.27	unknown	https://doi.org/10.1055/S-2003-39697
Xanthyletin	65188	Click to see CC1(C=CC2=C(O1)C=C3C(=C2)C=CC(=O)O3)C	228.24	unknown	https://doi.org/10.3987/COM-08-11630 https://doi.org/10.1248/CPB.58.61 https://doi.org/10.1055/S-2003-39697
> Phenylpropanoids and polyketides / Flavonoids / Flavans / 6-prenylated flavans / 6-prenylated flavanones
Cajaflavanone	42607935	Click to see CC(=CCC1=C(C2=C(C3=C1OC(C=C3)(C)C)OC(CC2=O)C4=CC=C(C=C4)O)O)C	406.50	unknown	https://doi.org/10.3987/COM-08-11630 https://doi.org/10.1248/CPB.58.61
Erythrisenegalone	15224381	Click to see CC(=CCC1=C(C2=C(C3=C1OC(C=C3)(C)C)OC(CC2=O)C4=CC=C(C=C4)O)O)C	406.50	unknown	https://doi.org/10.1248/CPB.58.61 https://doi.org/10.3987/COM-08-11630
> Phenylpropanoids and polyketides / Flavonoids / Flavans / 8-prenylated flavans / 8-prenylated flavanones
(2S)-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6,8-bis(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one	51535943	Click to see CC(=CCC1=C(C(=C2C(=C1O)C(=O)CC(O2)C3=CC(=C(C=C3)O)OC)CC=C(C)C)O)C	438.50	unknown	https://doi.org/10.3987/COM-08-11630 https://doi.org/10.1248/CPB.58.61
(S)-2,3-Dihydro-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6,8-bis(3-methyl-2-butenyl)-4H-1-benzopyran-4-one	14542255	Click to see CC(=CCC1=C(C(=C2C(=C1O)C(=O)CC(O2)C3=CC(=C(C=C3)O)OC)CC=C(C)C)O)C	438.50	unknown	https://doi.org/10.3987/COM-08-11630 https://doi.org/10.1248/CPB.58.61
2-(4-Hydroxyphenyl)-5-hydroxy-2,3-dihydro-10-(3-methyl-2-butenyl)-8,8-dimethyl-4H,8H-benzo[1,2-b:5,4-b']dipyran-4-one	13846826	Click to see CC(=CCC1=C2C(=C(C3=C1OC(CC3=O)C4=CC=C(C=C4)O)O)C=CC(O2)(C)C)C	406.50	unknown	https://doi.org/10.1248/CPB.58.61 https://doi.org/10.3987/COM-08-11630
5,7-Dihydroxy-2-(4-hydroxyphenyl)-6,8-bis(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one	3951	Click to see CC(=CCC1=C(C(=C2C(=C1O)C(=O)CC(O2)C3=CC=C(C=C3)O)CC=C(C)C)O)C	408.50	unknown	https://doi.org/10.1248/CPB.58.61 https://doi.org/10.3987/COM-08-11630
Lonchocarpol A	124035	Click to see CC(=CCC1=C(C(=C2C(=C1O)C(=O)CC(O2)C3=CC=C(C=C3)O)CC=C(C)C)O)C	408.50	unknown	https://doi.org/10.1248/CPB.58.61 https://doi.org/10.3987/COM-08-11630
Lupinifolin	10250777	Click to see CC(=CCC1=C2C(=C(C3=C1OC(CC3=O)C4=CC=C(C=C4)O)O)C=CC(O2)(C)C)C	406.50	unknown	https://doi.org/10.1248/CPB.58.61 https://doi.org/10.3987/COM-08-11630
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Flavanones
(2S)-7-hydroxyflavanone	688857	Click to see C1C(OC2=C(C1=O)C=CC(=C2)O)C3=CC=CC=C3	240.25	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	https://doi.org/10.1021/NP060217S
Naringenin	439246	Click to see C1C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC=C(C=C3)O	272.25	unknown	https://doi.org/10.1021/NP060217S
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Flavanones / Flavanonols
(-)-Epitaxifolin	712318	Click to see C1=CC(=C(C=C1C2C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O	304.25	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	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavones / Flavonols
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
Limocitrol	12311234	Click to see COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C(=C(C(=C3O2)OC)O)OC)O)O)O	376.30	unknown	via CMAUP database
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	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid 3-O-p-coumaroyl glycosides
kaempferol 3-O-(6"-O-feruloyl)-glucoside	23265189	Click to see COC1=C(C=CC(=C1)C=CC(=O)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O	624.50	unknown	via CMAUP database
Tiliroside	5320686	Click to see C1=CC(=CC=C1C=CC(=O)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O	594.50	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid C-glycosides
5-[[(2R,3S,4S,5R,6S)-3,4-dihydroxy-6-[5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-7-yl]-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methoxy]-3-hydroxy-3-methyl-5-oxopentanoic acid	101485562	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2C3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)COC(=O)CC(C)(CC(=O)O)O)O)O)O)O)O	708.70	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid C-glycosides / Flavonoid 8-C-glycosides
5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-8-[(2S,4R,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one	44258170	Click to see COC1=C(C=CC(=C1)C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)C4C(C(C(C(O4)CO)O)O)O)O	462.40	unknown	via CMAUP database
5,7-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one	5383409	Click to see COC1=C(C=CC(=C1)C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)C4C(C(C(C(O4)CO)O)O)O)O	462.40	unknown	via CMAUP database
5,7-dihydroxy-2-(4-hydroxyphenyl)-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one	5378180	Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)C4C(C(C(C(O4)CO)O)O)O)O	432.40	unknown	https://doi.org/10.1248/CPB.58.61 https://doi.org/10.3987/COM-08-11630
Scoparin	20055255	Click to see COC1=C(C=CC(=C1)C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)C4C(C(C(C(O4)CO)O)O)O)O	462.40	unknown	via CMAUP database
Vitexin	5280441	Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)C4C(C(C(C(O4)CO)O)O)O)O	432.40	unknown	https://doi.org/10.3987/COM-08-11630 https://doi.org/10.1248/CPB.58.61
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides
(3S)-5-[[(2R,3S,4S,5R,6S)-6-[4-(5,7-dihydroxy-6,8-dimethoxy-4-oxochromen-2-yl)-2-methoxyphenoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-3-hydroxy-3-methyl-5-oxopentanoic acid	162862198	Click to see CC(CC(=O)O)(CC(=O)OCC1C(C(C(C(O1)OC2=C(C=C(C=C2)C3=CC(=O)C4=C(C(=C(C(=C4O3)OC)O)OC)O)OC)O)O)O)O	666.60	unknown	https://doi.org/10.1021/NP060217S https://doi.org/10.1016/S0031-9422(00)84522-7
(3S)-5-[[(2R,3S,4S,5R,6S)-6-[4-[(2S)-5,7-dihydroxy-4-oxo-2,3-dihydrochromen-2-yl]-2-methoxyphenoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-3-hydroxy-3-methyl-5-oxopentanoic acid	162980998	Click to see CC(CC(=O)O)(CC(=O)OCC1C(C(C(C(O1)OC2=C(C=C(C=C2)C3CC(=O)C4=C(C=C(C=C4O3)O)O)OC)O)O)O)O	608.50	unknown	https://doi.org/10.1021/NP060217S
2-[4-(beta-D-Glucopyranosyloxy)-3-methoxyphenyl]-5,7-dihydroxy-6,8-dimethoxy-4H-1-benzopyran-4-one	21721960	Click to see COC1=C(C=CC(=C1)C2=CC(=O)C3=C(C(=C(C(=C3O2)OC)O)OC)O)OC4C(C(C(C(O4)CO)O)O)O	522.50	unknown	https://doi.org/10.1246/BCSJ.55.2928
4H-1-Benzopyran-4-one, 2-[4-[[6-O-(4-carboxy-3-hydroxy-3-methyl-1-oxobutyl)-beta-D-glucopyranosyl]oxy]-3-methoxyphenyl]-5,7-dihydroxy-6,8-dimethoxy-	74977948	Click to see CC(CC(=O)O)(CC(=O)OCC1C(C(C(C(O1)OC2=C(C=C(C=C2)C3=CC(=O)C4=C(C(=C(C(=C4O3)OC)O)OC)O)OC)O)O)O)O	666.60	unknown	https://doi.org/10.1021/NP060217S https://doi.org/10.1016/S0031-9422(00)84522-7
5-[[6-[4-(5,7-Dihydroxy-4-oxo-2,3-dihydrochromen-2-yl)-2-methoxyphenoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-3-hydroxy-3-methyl-5-oxopentanoic acid	73236892	Click to see CC(CC(=O)O)(CC(=O)OCC1C(C(C(C(O1)OC2=C(C=C(C=C2)C3CC(=O)C4=C(C=C(C=C4O3)O)O)OC)O)O)O)O	608.50	unknown	https://doi.org/10.1021/NP060217S
Bis[[6-[4-(5,7-dihydroxy-6,8-dimethoxy-4-oxochromen-2-yl)-2-methoxyphenoxy]-3,4,5-trihydroxyoxan-2-yl]methyl] 3-hydroxy-3-methylpentanedioate	162950443	Click to see CC(CC(=O)OCC1C(C(C(C(O1)OC2=C(C=C(C=C2)C3=CC(=O)C4=C(C(=C(C(=C4O3)OC)O)OC)O)OC)O)O)O)(CC(=O)OCC5C(C(C(C(O5)OC6=C(C=C(C=C6)C7=CC(=O)C8=C(C(=C(C(=C8O7)OC)O)OC)O)OC)O)O)O)O	1171.00	unknown	https://doi.org/10.1016/S0031-9422(00)84522-7
kaempferol 5-O-beta-L-glucopyranoside	72551435	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(O2)C=C(C=C3OC4C(C(C(C(O4)CO)O)O)O)O)O)O	448.40	unknown	via CMAUP database
Sudachiin A	73829938	Click to see COC1=C(C=CC(=C1)C2=CC(=O)C3=C(C(=C(C(=C3O2)OC)O)OC)O)OC4C(C(C(C(O4)CO)O)O)O	522.50	unknown	https://doi.org/10.1246/BCSJ.55.2928 https://doi.org/10.1271/NOGEIKAGAKU1924.59.405 https://doi.org/10.1016/S0031-9422(00)84522-7
Sudachiin B	131752542	Click to see CC(CC(=O)OCC1C(C(C(C(O1)OC2=C(C=C(C=C2)C3=CC(=O)C4=C(C(=C(C(=C4O3)OC)O)OC)O)OC)O)O)O)(COC=O)O	666.60	unknown	https://doi.org/10.1016/S0031-9422(00)84522-7
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides
3-[(2S,3R,4S,5R,6R)-3,5-dihydroxy-6-(hydroxymethyl)-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5-hydroxy-7-methoxychromen-4-one	101714010	Click to see COC1=CC(=C2C(=C1)OC(=C(C2=O)OC3C(C(C(C(O3)CO)O)OC4C(C(C(C(O4)CO)O)O)O)O)C5=CC(=C(C=C5)O)O)O	640.50	unknown	via CMAUP database
3-[(3-O-beta-D-Glucopyranosyl-beta-D-glucopyranosyl)oxy]-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-1-benzopyran-4-one	101683505	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)OC5C(C(C(C(O5)CO)O)O)O)O)O	640.50	unknown	via CMAUP database
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
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	via CMAUP database
Isoquercitin	10813969	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
kaempferol 3-O-beta-L-glucopyranoside	9911508	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
Quercetin 3-laminaribioside	101683504	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)OC5C(C(C(C(O5)CO)O)O)O)O)O)O	626.50	unknown	via CMAUP database
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/10.1016/0031-9422(93)85237-L
Trifolin	5282149	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
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-7-O-glycosides
(2R)-2-(3,4-dihydroxyphenyl)-5-hydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2,3-dihydrochromen-4-one	154496534	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	https://doi.org/10.1021/NP060217S
(2R)-7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-3-[(2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-6-[[(2R,3S,4R,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one	163003082	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)OC6C(C(C(C(O6)C)O)O)O)O)O)O)O)O	726.70	unknown	https://doi.org/10.1021/NP060217S
(2S)-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2,3-dihydrochromen-4-one	129010007	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)OC)O)O)O)O)O)O)O)O	610.60	unknown	https://doi.org/10.1271/NOGEIKAGAKU1924.59.405 https://doi.org/10.1016/0031-9422(93)85237-L
(2S)-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-[(2S,3R,4S,5S,6S)-3,4,5-trihydroxy-6-[[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2,3-dihydrochromen-4-one	154496727	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)OC)O)O)O)O)O)O)O)O	610.60	unknown	https://doi.org/10.1021/NP060217S
(2S)-5-hydroxy-2-(4-hydroxyphenyl)-7-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one	154497293	Click to see C1C(OC2=CC(=CC(=C2C1=O)O)OC3C(C(C(C(O3)CO)O)O)O)C4=CC=C(C=C4)O	434.40	unknown	https://doi.org/10.1021/NP060217S
(2S)-5-hydroxy-2-(4-hydroxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4R,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2,3-dihydrochromen-4-one	158618954	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	https://doi.org/10.1021/NP060217S
(2S)-7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-5-hydroxy-2-(3-hydroxy-4-methoxy-phenyl)chroman-4-one	457806	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)OC)O)O)CO)O)O)O)O)O	610.60	unknown	via CMAUP database
(2S)-7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-2,3-dihydrochromen-4-one	154497077	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)OC)O)O)CO)O)O)O)O)O	610.60	unknown	https://doi.org/10.1021/NP060217S
(2S)-7-[(2S,3R,4S,5S,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one	95858668	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O	580.50	unknown	https://doi.org/10.1021/NP060217S
(2S)-7-[(2S,3S,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one	129010093	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O	580.50	unknown	https://doi.org/10.1016/0031-9422(93)85237-L
(2S)-7-[(2S,3S,4S,5S,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(4-methoxyphenyl)-2,3-dihydrochromen-4-one	154497260	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)OC)O)CO)O)O)O)O)O	594.60	unknown	https://doi.org/10.1021/NP060217S
(2S)-7-[(2S,3S,4S,5S,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(4-methoxyphenyl)-2,3-dihydrochromen-4-one	163189290	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)OC)O)CO)O)O)O)O)O	594.60	unknown	https://doi.org/10.1021/NP060217S
(2S)-7-[[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-oxanyl]oxy]-2-oxanyl]oxy]-5-hydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one	6710627	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O	580.50	unknown	via CMAUP database
(2S)-7-[4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5-hydroxy-2,3-dihydrochromen-4-one	42607966	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)O)O)O)CO)O)O)O)O)O	596.50	unknown	via CMAUP database
(2S)-7-[4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one	5351463	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O	580.50	unknown	via CMAUP database
(3R)-3-hydroxy-3-methyl-5-oxo-5-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-6,8-dimethoxy-4-oxochromen-7-yl]oxyoxan-2-yl]methoxy]pentanoic acid	163028542	Click to see CC(CC(=O)O)(CC(=O)OCC1C(C(C(C(O1)OC2=C(C(=C3C(=O)C=C(OC3=C2OC)C4=CC(=C(C=C4)O)OC)O)OC)O)O)O)O	666.60	unknown	https://doi.org/10.1021/NP060217S https://doi.org/10.1016/S0031-9422(00)84522-7
(3S)-3-hydroxy-3-methyl-5-oxo-5-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-hydroxy-2-(4-hydroxyphenyl)-6,8-dimethoxy-4-oxochromen-7-yl]oxyoxan-2-yl]methoxy]pentanoic acid	163045851	Click to see CC(CC(=O)O)(CC(=O)OCC1C(C(C(C(O1)OC2=C(C(=C3C(=O)C=C(OC3=C2OC)C4=CC=C(C=C4)O)O)OC)O)O)O)O	636.60	unknown	https://doi.org/10.1021/NP060217S
(S)-3',5-Dihydroxy-4'-methoxy-7-[2-O,6-O-di(alpha-L-rhamnopyranosyl)-beta-D-glucopyranosyloxy]flavanone	102316658	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)OC)O)O)OC6C(C(C(C(O6)C)O)O)O)O)O)O)O)O	756.70	unknown	https://doi.org/10.1021/NP060217S
(S)-7-(((2-O-6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-2,3-dihydro-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4H-1-benzopyran-4-one	442439	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)OC)O)O)CO)O)O)O)O)O	610.60	unknown	https://doi.org/10.1021/NP060217S https://doi.org/10.1111/J.1365-2672.2007.03456.X
1-O-[[(2R,3S,4S,5R,6S)-6-[4-(5,7-dihydroxy-6,8-dimethoxy-4-oxochromen-2-yl)-2-methoxyphenoxy]-3,4,5-trihydroxyoxan-2-yl]methyl] 5-O-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-6,8-dimethoxy-4-oxochromen-7-yl]oxyoxan-2-yl]methyl] (3R)-3-hydroxy-3-methylpentanedioate	163188511	Click to see CC(CC(=O)OCC1C(C(C(C(O1)OC2=C(C=C(C=C2)C3=CC(=O)C4=C(C(=C(C(=C4O3)OC)O)OC)O)OC)O)O)O)(CC(=O)OCC5C(C(C(C(O5)OC6=C(C(=C7C(=O)C=C(OC7=C6OC)C8=CC(=C(C=C8)O)OC)O)OC)O)O)O)O	1171.00	unknown	https://doi.org/10.1016/S0031-9422(00)84522-7
1-O-[[(2S,3S,4S,5S,6S)-6-[4-(5,7-dihydroxy-6,8-dimethoxy-4-oxochromen-2-yl)-2-methoxyphenoxy]-3,4,5-trihydroxyoxan-2-yl]methyl] 5-O-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-6,8-dimethoxy-4-oxochromen-7-yl]oxyoxan-2-yl]methyl] (3R)-3-hydroxy-3-methylpentanedioate	162904044	Click to see CC(CC(=O)OCC1C(C(C(C(O1)OC2=C(C=C(C=C2)C3=CC(=O)C4=C(C(=C(C(=C4O3)OC)O)OC)O)OC)O)O)O)(CC(=O)OCC5C(C(C(C(O5)OC6=C(C(=C7C(=O)C=C(OC7=C6OC)C8=CC(=C(C=C8)O)OC)O)OC)O)O)O)O	1171.00	unknown	https://doi.org/10.1016/S0031-9422(00)84522-7
1-O-[[6-[4-(5,7-dihydroxy-6,8-dimethoxy-4-oxochromen-2-yl)-2-methoxyphenoxy]-3,4,5-trihydroxyoxan-2-yl]methyl] 5-O-[[3,4,5-trihydroxy-6-[5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-6,8-dimethoxy-4-oxochromen-7-yl]oxyoxan-2-yl]methyl] 3-hydroxy-3-methylpentanedioate	73829942	Click to see CC(CC(=O)OCC1C(C(C(C(O1)OC2=C(C=C(C=C2)C3=CC(=O)C4=C(C(=C(C(=C4O3)OC)O)OC)O)OC)O)O)O)(CC(=O)OCC5C(C(C(C(O5)OC6=C(C(=C7C(=O)C=C(OC7=C6OC)C8=CC(=C(C=C8)O)OC)O)OC)O)O)O)O	1171.00	unknown	https://doi.org/10.1016/S0031-9422(00)84522-7
2-(2,5-Dihydroxyphenyl)-5-hydroxy-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one	73007499	Click to see C1C(OC2=CC(=CC(=C2C1=O)O)OC3C(C(C(C(O3)CO)O)O)O)C4=C(C=CC(=C4)O)O	450.40	unknown	https://doi.org/10.1248/CPB.58.61 https://doi.org/10.3987/COM-08-11630
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	https://doi.org/10.1021/NP060217S
3-Hydroxy-3-methyl-5-oxo-5-[[3,4,5-trihydroxy-6-[5-hydroxy-2-(4-hydroxyphenyl)-6,8-dimethoxy-4-oxochromen-7-yl]oxyoxan-2-yl]methoxy]pentanoic acid	73236890	Click to see CC(CC(=O)O)(CC(=O)OCC1C(C(C(C(O1)OC2=C(C(=C3C(=O)C=C(OC3=C2OC)C4=CC=C(C=C4)O)O)OC)O)O)O)O	636.60	unknown	https://doi.org/10.1021/NP060217S
4H-1-Benzopyran-4-one, 7-((2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-, (S)-	5284651	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O	580.50	unknown	via CMAUP database
4H-1-Benzopyran-4-one, 7-[[2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-, (2S)-	4441	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O	580.50	unknown	via CMAUP database
4H-1-Benzopyran-4-one, 7-[[2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-, (S)-	91740219	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O	580.50	unknown	via CMAUP database
4H-1-Benzopyran-4-one, 7-[[6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-2,3-dihydro-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-, (S)-	3594	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)OC)O)O)O)O)O)O)O)O	610.60	unknown	https://doi.org/10.1021/NP060217S
5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl 2-O-(-L-rhamnopyranosyl)-beta-D-glucopyranoside	45479322	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=C3)OC(=CC4=O)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O	578.50	unknown	via CMAUP database
5-Hydroxy-2-(4-hydroxyphenyl)-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one	282013	Click to see C1C(OC2=CC(=CC(=C2C1=O)O)OC3C(C(C(C(O3)CO)O)O)O)C4=CC=C(C=C4)O	434.40	unknown	https://doi.org/10.1021/NP060217S
7-[(2-O-alpha-L-Rhamnopyranosyl-beta-D-glucopyranosyl)oxy]-3',5-dihydroxy-4'-methoxyflavanone	17751030	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)OC)O)O)CO)O)O)O)O)O	610.60	unknown	via CMAUP database
7-[(2R,3S,4R,5R,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one	45358136	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O	580.50	unknown	via CMAUP database
7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5-hydroxy-2,3-dihydrochromen-4-one	91873173	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)O)O)O)CO)O)O)O)O)O	596.50	unknown	via CMAUP database
7-[(2S,4R,5S)-4,5-Dihydroxy-6-(hydroxymethyl)-3-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5-hydroxy-2,3-dihydrochromen-4-one	24211956	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)O)O)O)CO)O)O)O)O)O	596.50	unknown	via CMAUP database
7-[(2S,4R,5S)-4,5-Dihydroxy-6-(hydroxymethyl)-3-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-2,3-dihydrochromen-4-one	24211957	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)OC)O)O)CO)O)O)O)O)O	610.60	unknown	via CMAUP database
7-[(2S,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-2,3-dihydrochromen-4-one	91820153	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)OC)O)O)CO)O)O)O)O)O	610.60	unknown	via CMAUP database
7-[(2S,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one	74787988	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O	580.50	unknown	via CMAUP database
7-[(3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-2,3-dihydrochromen-4-one	45358138	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)OC)O)O)CO)O)O)O)O)O	610.60	unknown	via CMAUP database
7-[(3S,4R,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5-hydroxy-2,3-dihydrochromen-4-one	74787987	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)O)O)O)CO)O)O)O)O)O	596.50	unknown	via CMAUP database
7-[[2-O-(6-deoxy-alpha-l-mannopyranosyl)-beta-d-glucopyranosyl]oxy]-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-4h-1-benzopyran-4-one	25075	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O	580.50	unknown	via CMAUP database
7-[[6-O-(4-Carboxy-3-hydroxy-3-methyl-1-oxobutyl)-beta-D-glucopyranosyl]oxy]-5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-6,8-dimethoxy-4H-1-benzopyran-4-one	73829940	Click to see CC(CC(=O)O)(CC(=O)OCC1C(C(C(C(O1)OC2=C(C(=C3C(=O)C=C(OC3=C2OC)C4=CC(=C(C=C4)O)OC)O)OC)O)O)O)O	666.60	unknown	https://doi.org/10.1021/NP060217S https://doi.org/10.1016/S0031-9422(00)84522-7
7-[4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-2,3-dihydrochromen-4-one	138107793	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)OC)O)O)CO)O)O)O)O)O	610.60	unknown	https://doi.org/10.1271/NOGEIKAGAKU1924.59.405
Apigenin 7-O-neohesperidoside	5459217	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=C3)OC(=CC4=O)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O	578.50	unknown	via CMAUP database
Apigenin-7-O-neohesperidoside	5483904	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=C3)OC(=CC4=O)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O	578.50	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
Diosmin	5281613	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)O	608.50	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	https://doi.org/10.1021/NP060217S
Eriodictyol-7-O-neohesperidoside	4278576	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)O)O)O)CO)O)O)O)O)O	596.50	unknown	via CMAUP database
Hesperetin 7-(2,6-dirhamnosylglucoside)	74819396	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)OC)O)O)OC6C(C(C(C(O6)C)O)O)O)O)O)O)O)O	756.70	unknown	https://doi.org/10.1021/NP060217S
Hesperetin 7-neohesperidoside	73395	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)OC)O)O)CO)O)O)O)O)O	610.60	unknown	via CMAUP database
Hesperetin 7-O-neohesperidoside	42608011	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)OC)O)O)CO)O)O)O)O)O	610.60	unknown	via CMAUP database
Hesperetin-rutinoside	53477767	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)OC)O)O)O)O)O)O)O)O	610.60	unknown	via CMAUP database
Hesperidin	10621	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)OC)O)O)O)O)O)O)O)O	610.60	unknown	https://doi.org/10.1021/NP060217S https://doi.org/10.1271/NOGEIKAGAKU1924.59.405 https://doi.org/10.1016/0031-9422(93)85237-L
Isosakuranetin-7-neohesperidoside	4463283	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)OC)O)CO)O)O)O)O)O	594.60	unknown	https://doi.org/10.1021/NP060217S
Kaempferol 7-O-alpha-L-rhamnopyranoside-4'-O-beta-D-glucopyranoside	101949540	Click to see CC1C(C(C(C(O1)OC2=CC(=C3C(=C2)OC(=C(C3=O)O)C4=CC=C(C=C4)OC5C(C(C(C(O5)CO)O)O)O)O)O)O)O	594.50	unknown	via CMAUP database
Naringenin 7-O-(2'',6''-di-O-alpha-rhamnopyranosyl)-beta-glucopyranoside	5278403	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)OC6C(C(C(C(O6)C)O)O)O)O)O)O)O)O	726.70	unknown	https://doi.org/10.1021/NP060217S
Naringenin 7-rutinoside	85704	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	https://doi.org/10.1016/J.TOX.2010.01.012 https://doi.org/10.1021/NP060217S https://doi.org/10.1016/J.FCT.2012.07.007
Naringin	442428	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O	580.50	unknown	https://doi.org/10.1021/NP060217S
Naringin [10236-47-2]	45933923	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O	580.50	unknown	via CMAUP database
Naringin 6''-rhamnoside	74819376	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)OC6C(C(C(C(O6)C)O)O)O)O)O)O)O)O	726.70	unknown	https://doi.org/10.1021/NP060217S
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	https://doi.org/10.1016/J.TOX.2010.01.012 https://doi.org/10.1016/J.FCT.2012.07.007 https://doi.org/10.1021/NP060217S https://doi.org/10.1007/S11418-012-0699-Y https://doi.org/10.1016/0031-9422(93)85237-L
Neoeriocitrin	114627	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)O)O)O)CO)O)O)O)O)O	596.50	unknown	via CMAUP database
Neohesperidin	232990	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)OC)O)O)CO)O)O)O)O)O	610.60	unknown	https://doi.org/10.1021/NP060217S
Poncirin	442456	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)OC)O)CO)O)O)O)O)O	594.60	unknown	https://doi.org/10.1021/NP060217S
Prunin	92794	Click to see C1C(OC2=CC(=CC(=C2C1=O)O)OC3C(C(C(C(O3)CO)O)O)O)C4=CC=C(C=C4)O	434.40	unknown	https://doi.org/10.1021/NP060217S
Rhoifolin	5282150	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=C3)OC(=CC4=O)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O	578.50	unknown	via CMAUP database
Rhoifolin [17306-46-6]	45933935	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=C3)OC(=CC4=O)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O	578.50	unknown	via CMAUP database
Sudachiin C	131752543	Click to see CC(CC(=O)OCC1C(C(C(C(O1)OC2=C(C(=C3C(=O)C=C(OC3=C2OC)C4=CC(=C(C=C4)O)OC)O)OC)O)O)O)(COC=O)O	666.60	unknown	https://doi.org/10.1016/S0031-9422(00)84522-7
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 4-O-methylated flavonoids
Hesperetin	72281	Click to see COC1=C(C=C(C=C1)C2CC(=O)C3=C(C=C(C=C3O2)O)O)O	302.28	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 6-O-methylated flavonoids
Hispidulin	5281628	Click to see COC1=C(C2=C(C=C1O)OC(=CC2=O)C3=CC=C(C=C3)O)O	300.26	unknown	https://doi.org/10.1016/0031-9422(81)85121-7
Jaceosidin	5379096	Click to see COC1=C(C=CC(=C1)C2=CC(=O)C3=C(O2)C=C(C(=C3O)OC)O)O	330.29	unknown	https://doi.org/10.1021/NP060217S https://doi.org/10.1016/0031-9422(81)85121-7
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 7-O-methylated flavonoids
4H-1-Benzopyran-4-one, 5-hydroxy-3,7-dimethoxy-2-phenyl-	5748697	Click to see COC1=CC(=C2C(=C1)OC(=C(C2=O)OC)C3=CC=CC=C3)O	298.29	unknown	via CMAUP database
5-Hydroxy-7-methoxy-2-phenylchroman-4-one	73201	Click to see COC1=CC(=C2C(=O)CC(OC2=C1)C3=CC=CC=C3)O	270.28	unknown	via CMAUP database
Mosloflavone	471722	Click to see COC1=C(C(=C2C(=C1)OC(=CC2=O)C3=CC=CC=C3)O)OC	298.29	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 8-O-methylated flavonoids
5-Hydroxy-3,7,8-trimethoxyflavone	21632881	Click to see COC1=C(C2=C(C(=C1)O)C(=O)C(=C(O2)C3=CC=CC=C3)OC)OC	328.30	unknown	via CMAUP database
8-Methoxycirsilineol	181092	Click to see COC1=C(C=CC(=C1)C2=CC(=O)C3=C(C(=C(C(=C3O2)OC)OC)OC)O)O	374.30	unknown	https://doi.org/10.1016/0031-9422(81)85121-7 https://doi.org/10.1021/NP060217S
Demethoxysudachitin	3083845	Click to see COC1=C(C(=C2C(=C1O)C(=O)C=C(O2)C3=CC=C(C=C3)O)OC)O	330.29	unknown	https://doi.org/10.1021/NP060217S
Nobiletin	72344	Click to see COC1=C(C=C(C=C1)C2=CC(=O)C3=C(O2)C(=C(C(=C3OC)OC)OC)OC)OC	402.40	unknown	via CMAUP database
Sudachitin	12443122	Click to see COC1=C(C=CC(=C1)C2=CC(=O)C3=C(C(=C(C(=C3O2)OC)O)OC)O)O	360.30	unknown	https://doi.org/10.1021/NP060217S
Tangeretin	68077	Click to see COC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C(=C(C(=C3OC)OC)OC)OC	372.40	unknown	https://doi.org/10.1248/CPB.39.945
Xanthomicrol	73207	Click to see COC1=C(C(=C2C(=C1O)C(=O)C=C(O2)C3=CC=C(C=C3)O)OC)OC	344.30	unknown	https://doi.org/10.1021/NP060217S https://doi.org/10.1016/0031-9422(81)85121-7
> Phenylpropanoids and polyketides / Flavonoids / Pyranoflavonoids
(2S)-5-hydroxy-2-(4-hydroxyphenyl)-8,8-dimethyl-2,3-dihydropyrano[2,3-h]chromen-4-one	14187086	Click to see CC1(C=CC2=C(O1)C=C(C3=C2OC(CC3=O)C4=CC=C(C=C4)O)O)C	338.40	unknown	https://doi.org/10.1248/CPB.36.3292 https://doi.org/10.3987/COM-08-11630 https://doi.org/10.1248/CPB.58.61
Citflavanone	14187085	Click to see CC1(C=CC2=C(O1)C=C(C3=C2OC(CC3=O)C4=CC=C(C=C4)O)O)C	338.40	unknown	https://doi.org/10.3987/COM-08-11630 https://doi.org/10.1248/CPB.58.61
> Phenylpropanoids and polyketides / Linear 1,3-diarylpropanoids / Chalcones and dihydrochalcones / 2-Hydroxychalcones
Larrein	9993268	Click to see COC1=C(C=CC(=C1O)C(=O)C=CC2=CC=CC=C2)O	270.28	unknown	via CMAUP database

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Citrus medica

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