Daucus carota

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Description

Synonyms

Common Names

Subtypes (subspecies, varieties, subvarieties, forms)

Germination/Propagation

Distribution

Links to other databases

Genome

Scientific Literature

Phytochemical Profile

Biological Material

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Details Top

Internal ID	UUID644015da424e4277594762
Scientific name	Daucus carota
Authority	L.
First published in	Sp. Pl. : 242 (1753)

Description Top

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Synonyms Top

Scientific name	Authority	First published in
Platyspermum alatum	Schult.	Syst. Veg., ed. 15 bis 6: 837 (1820)
Tiricta daucoides	Raf.	New Fl. 4: 23 (1838)
Daucus carota var. brachycaulos	Reduron	Ombellif. France 2: 1079 (2007)
Daucus carota var. linearis	Reduron	Ombellif. France 2: 1081 (2007)
Daucus carota var. pseudocarota	(Rouy & E.G.Camus) Reduron	Ombellif. France 2: 1083 (2007)
Daucus communis var. pseudocarota	Rouy & E.G.Camus	Fl. France 7: 239 (1901)
Carota sylvestris	Rupr.	Fl. Ingrica : 468 (1860)
Caucalis carnosa	Roth	Tent. Fl. Germ. 1: 119 (1788)
Caucalis carota	Crantz	Cl. Umbell. Emend. : 113 (1767)
Caucalis daucus	Crantz	Stirp. Austr. Fasc. 2: 125 (1763)
Daucus agrestis	Raf.	New Fl. 4: 27 (1838)
Daucus alatus	Poir.	Voy. Barbarie 2: 135 (1789)
Daucus allioni	Link	Handbuch 1: 344 (1829)
Daucus australis	Kotov	Bot. Zhurn. (Kiev) 1(2): 278. 1940
Daucus blanchei	Reut.	Fl. Orient. 2: 1077 (1872)
Daucus brevicaulis	Raf.	New Fl. 4: 25 (1838)
Daucus carota subsp. dentatus	(Bertol.) Fiori	Fl. Italia 2: 186 1900
Daucus carota f. epurpurata	Farw.	Pap. Michigan Acad. Sci. 2: 35 (1923)
Daucus carota f. fischeri	Moldenke	Castanea 9: 55. 1944
Daucus carota f. goodmanii	Moldenke	Castanea 9: 55. 1944
Daucus carota subsp. hispidus	Masclef	J. Bot. (Morot) 3(2): 22 1889
Daucus carota f. rosea	Millsp.	Fl. W. Virginia : 369 (1892)
Daucus carota f. roseus	Farw.	Rep. (Annual) Michigan Acad. Sci. 21: 369. 1920
Daucus communis	Rouy & E.G.Camus	Fl. France 7: 231 (1901)
Daucus dentatus	Bertol.	Fl. Ital. 3: 168 (1837)
Daucus esculentus	Salisb.	Prodr. Stirp. Chap. Allerton : 162 (1796)
Daucus exiguus	Steud.	Nomencl. Bot. , ed. 2, 1: 485 (1840)
Daucus glaber	Opiz ex Čelak.	Prodr. Fl. Böhmen iii. 582.
Daucus heterophylus	Raf.	New Fl. 4: 26 (1838)
Daucus kotovii	M.Hiroe	Umbell. World : 595 (1979)
Daucus levis	Raf.	New Fl. 4: 25 (1838)
Daucus littoralis var. glabra	(Forssk.) Hosni	Taeckholmia 12: 54. 1989
Daucus littoralis var. negevensis	Plitmann	Fl. Palaestina 2: 460. 1972
Daucus marcidus	Timb.-Lagr.	Bull. Soc. Bot. France 13: clv (1866)
Daucus maritimus	With.	Arr. Brit. Pl., ed. 3. ii. 290. 1796
Daucus montanus	Schmidt ex Nyman	Consp. Fl. Eur. : 279 (1879)
Daucus neglectus	Lowe	Trans. Cambridge Philos. Soc. 6: 542 (1838)
Daucus nudicaulis	Raf.	New Fl. 4: 25 (1838)
Daucus officinalis	Gueldenst. ex Ledeb.	Fl. Ross. 2: 339 (1844)
Daucus polygamus	Jacq. ex Nyman	Consp. Fl. Eur. 2: 279. 1879 [Oct 1879]
Daucus scariosus	Raf.	New Fl. 4: 25 (1838)
Daucus sciadophylus	Raf.	New Fl. 4: 24 (1838)
Daucus strigosus	Raf.	New Fl. 4: 27 (1838)
Daucus sylvestris	Mill.	Gard. Dict. ed. 8 : n.º 1 (1768)
Daucus vulgaris	Garsault	Fig. Pl. Med. 2: t. 246. 1764, nom. inval., opus utique oppressum; Descr. Pl. Anim. 159. 1767; Thell. in Bull. Herb. Boiss. Ser. II. viii. 789.
Daucus vulgaris	Neck.	Delic. Gallo-Belg. 1: 139 (1768)
Daucus carota var. brachycentrus	Maire	Bull. Soc. Hist. Nat. Afrique N. 22: 50 1931
Daucus carota var. excelsus	Maire	Bull. Soc. Hist. Nat. Afrique N. 20: 23 1929
Daucus littoralis var. forsskalii	Boiss.	Fl. Orient. 2: 1074 1872

Common names Top

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Filter by language:

Language	Common/alternative name
English	wild carrot
English	queen anne's lace
English	bird's nest
English	bishop's lace
English	devil’s plague
Afrikaans	wortel
Arabic	جزر شائع
Arabic	حزر
Arabic	سفناري
Azerbaijani	yabanı yerkökü
Belarusian	морква дзікая
Bulgarian	морков
Bulgarian	обикновен морков
Catalan	pastanaga
chy	anonévee'tose
co	rundonu
Czech	mrkev obecná
Welsh	meddyglyn
Welsh	llys meddyglyn
Welsh	moronen coch
Welsh	moronen wyllt
Welsh	moronen y maes
Welsh	nyth aderyn
Danish	gulerod
Danish	vild gulerod
German	möhre
German	gewöhnliche möhre
Esperanto	karoto
Estonian	metsporgand
Persian	هویج وحشی
Finnish	aitoporkkana
Finnish	porkkana
French	carotte sauvage
French	carotte
frr	wil wochel
Irish	cairéad
Irish	bliúcán
Irish	cuirdín
Irish	mealbhacán
gn	makychĩ guasu
Hebrew	גזר הגינה
Hindi	जंगली गाजर
Croatian	mrkva
Upper Sorbian	wšědna morchej
Hungarian	murok
Hungarian	vadrépa
Hungarian	vadmurok
Armenian	գազար վայրի
Indonesian	wortel liar
io	karoto
Icelandic	gulrót
Italian	carota
Japanese	ワイルドキャロット
Japanese	ノラニンジン
jv	wortel
Kabyle	tazdalt
Kazakh	Сәбіз
Kannada	ಗಜ್ಜರಿ
Korean	당근
ku	gêzer
Cornish	las myghternes anna
la	perideridia gairdneri
Lithuanian	paprastoji morka
Latvian	savvaļas burkāns
mai	गाजर
Macedonian	див морков
Malayalam	കാരറ്റ്
mn	Лууван
Malay	lobak
Burmese	မုန်လာဥဝါ
nah	xōchicamohtli
nan	Âng-chhài-thâu
nan	lĭn-jín
nap	pastenaca
Nepali	गाजर
Dutch	peen
Dutch	wilde peen
Norwegian Nynorsk	gulrot
nv	chąąshtʼezhiitsoh
os	Хъæддаг уырыдзы
pcd	carotte batarde
Polish	marchew zwyczajna
Punjab	جنگلی گاجر
Portuguese	cenoura
Quechua	sanurya
Romanian	morcov sălbatic
Romanian	morcov
Russian	морковь каротинная
Russian	морковь обыкновенная
Russian	морковь дикая
sd	گجر
Sinhala	කැරට්
Slovak	mrkva obyčajná
Slovenian	navadno korenje
Albanian	karrota
Serbian	Дивља мрква
Swedish	vildmorot
Tamil	மஞ்சள் முள்ளங்கி
tcy	ಕ್ಯಾರೇಟ್
tg	Зардак
Thai	แคร์รอต
Turkish	havuç
Ukrainian	морква дика
Urdu	گاجر
vep	morkofk
vls	krote
vls	workel
vls	wortel
vls	karote
Chinese	野胡萝卜
Chinese	胡萝卜
Chinese	胡蘿蔔
Chinese	南鹤虱
Chinese	野胡萝卜（胡萝卜）
Chinese	野胡萝卜子
Chinese	野胡萝卜根
Chinese	鹤虱风
Chinese	野胡蘿蔔

Subspecies (abbr. subsp./ssp.) Top

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Name	Authority	First published in
Daucus carota subsp. azoricus	Franco	Nova Fl. Portugal 1: 555 (1971)
Daucus carota subsp. cantabricus	A.Pujadas	Anales Jard. Bot. Madrid 59: 370 (2001 publ. 2002)
Daucus carota subsp. carota
Daucus carota subsp. commutatus	(Paol.) Thell.	Repert. Spec. Nov. Regni Veg. 22: 312. 1926 (1926)
Daucus carota subsp. drepanensis	(Arcang.) Heywood	Feddes Repert. 79: 68. 1968 (1968)
Daucus carota subsp. fontanesii	Thell.	Repert. Spec. Nov. Regni Veg. 22: 314 (1926)
Daucus carota subsp. gadecaei	(Rouy & E.G.Camus) Heywood	Feddes Repert. 79: 68. 1968 (1968)
Daucus carota subsp. gummifer	(Syme) Hook.f.	Student. Fl. Brit. Isl. , ed. 3: 185 (1884)
Daucus carota subsp. halophilus	(Brot.) A.Pujadas	Anales Jard. Bot. Madrid 59: 374 (2001 publ. 2002)
Daucus carota subsp. hispanicus	(Gouan) Thell.	Repert. Spec. Nov. Regni Veg. 22: 312. 1926 (1926)
Daucus carota subsp. majoricus	A.Pujadas	Anales Jard. Bot. Madrid 59: 372 (2001 publ. 2002)
Daucus carota subsp. maritimus	(Lam.) Batt.	Fl. Algérie Dicot.: 382. 1889 (1889)
Daucus carota subsp. maximus	(Desf.) Ball	J. Linn. Soc., Bot. 16: 476. 1878 (1878)
Daucus carota subsp. rupestris	(Guss.) Heywood	Feddes Repert. 79: 68. 1968 (1968)
Daucus carota subsp. sativus	(Hoffm.) Arcang.	Comp. Fl. Ital. 299 1882

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
  - Azores
  - Canary Islands
  - Cape Verde
  - Madeira
- Northeast Tropical Africa
  - Eritrea
  - Ethiopia
  - Sudan
- Northern Africa
  - Algeria
  - Libya
  - Morocco
  - Tunisia
- South Tropical Africa
  - Angola
- Southern Africa
  - Cape Provinces
  - Northern Provinces
- Western Indian Ocean
  - Mauritius
  - Rodrigues
  - Réunion

Antarctica click to expand
- Subantarctic Islands
  - Amsterdam-St.Paul Islands

Asia-temperate click to expand
- Caucasus
  - North Caucasus
  - Transcaucasus
- China
  - China North-central
  - China South-central
  - China Southeast
  - Hainan
  - Inner Mongolia
  - Manchuria
  - Qinghai
  - Tibet
  - Xinjiang
- Eastern Asia
  - Japan
  - Korea
- Middle Asia
  - Kazakhstan
  - Kirgizstan
  - Tadzhikistan
  - Turkmenistan
  - Uzbekistan
- Mongolia
  - Mongolia
- Russian Far East
  - Primorye
- Siberia
  - West Siberia
- Western Asia
  - Afghanistan
  - Cyprus
  - East Aegean Islands
  - Iran
  - Iraq
  - Lebanon-Syria
  - Palestine
  - Turkey

Asia-tropical click to expand
- Indian Subcontinent
  - Bangladesh
  - India
  - Nepal
  - Pakistan
  - Sri Lanka
  - West Himalaya
- Indo-China
  - Andaman Islands
  - Myanmar
  - Nicobar Nicobar
  - Vietnam
- Malesia
  - Jawa

Australasia click to expand
- Australia
  - Tasmania
- New Zealand
  - Kermadec Islands
  - New Zealand North
  - New Zealand South

Europe click to expand
- Eastern Europe
  - Baltic States
  - Belarus
  - Central European Russia
  - East European Russia
  - Krym
  - North European Russia
  - Northwest European Russia
  - South European Russia
  - Ukraine
- Middle Europe
  - Austria
  - Belgium
  - Czechoslovakia
  - Germany
  - Hungary
  - Netherlands
  - Poland
  - Switzerland
- Northern Europe
  - Denmark
  - Finland
  - Great Britain
  - Iceland
  - Ireland
  - Norway
  - Sweden
- Southeastern Europe
  - Albania
  - Bulgaria
  - Greece
  - Italy
  - Kriti
  - Romania
  - Sicilia
  - Turkey-in-Europe
  - Yugoslavia
- Southwestern Europe
  - Baleares
  - Corse
  - France
  - Portugal
  - Sardegna
  - Spain

Northern America click to expand
- Eastern Canada
  - Labrador
  - New Brunswick
  - Newfoundland
  - Nova Scotia
  - Ontario
  - Prince Edward Island
  - Québec
- Mexico
  - Mexico Central
  - Mexico Northeast
- North-central U.S.A.
  - Illinois
  - Iowa
  - Kansas
  - Minnesota
  - Missouri
  - Nebraska
  - North Dakota
  - Oklahoma
  - South Dakota
  - Wisconsin
- Northeastern U.S.A.
  - Connecticut
  - Indiana
  - Maine
  - Massachusetts
  - Michigan
  - New Hampshire
  - New Jersey
  - New York
  - Ohio
  - Pennsylvania
  - Rhode Island
  - Vermont
  - West Virginia
- Northwestern U.S.A.
  - Colorado
  - Idaho
  - Montana
  - Oregon
  - Washington
  - Wyoming
- South-central U.S.A.
  - New Mexico
  - Texas
- Southeastern U.S.A.
  - Alabama
  - Arkansas
  - Delaware
  - District Of Columbia
  - Florida
  - Georgia
  - Kentucky
  - Louisiana
  - Maryland
  - Mississippi
  - North Carolina
  - South Carolina
  - Tennessee
  - Virginia
- Southwestern U.S.A.
  - Arizona
  - California
  - Nevada
  - Utah
- Western Canada
  - British Columbia
  - Manitoba
  - Saskatchewan

Pacific click to expand
- Northwestern Pacific
  - Marianas
  - Marshall Islands
- South-central Pacific
  - Easter Island

Southern America click to expand
- Brazil
  - Brazil South
- Caribbean
  - Cuba
  - Dominican Republic
  - Haiti
  - Jamaica
  - Leeward Islands
  - Puerto Rico
  - Trinidad-Tobago
- Central America
  - Costa Rica
  - El Salvador
  - Guatemala
- Southern South America
  - Argentina Northeast
  - Argentina Northwest
  - Argentina South
  - Chile Central
  - Chile South
  - Desventurados Islands
  - Uruguay
- Western South America
  - Ecuador
  - Peru

Links to other databases Top

Suggest others/fix!

Database	ID/link to page
World Flora Online	wfo-0000638442
Florida Plant Atlas	1771
Flora of Alabama	341
Canadensys	2571
USDA Plants	DACA6
Tropicos	1701516
INPN	94503
Flora of Italy	3693
KEW	urn:lsid:ipni.org:names:841063-1
The Plant List	kew-2757936
Plantarium	12730
PFAF	Daucus carota
Open Tree Of Life	372836
Observations.org	6684
NCBI Taxonomy	4039
NBN Atlas	NBNSYS0000014362
Nature Serve	2.141876
IUCN Red List	172210
IPNI	841063-1
iNaturalist	76610
GBIF	3034742
Freebase	/m/01rx53
WisFlora	3356
EPPO	DAUCA
EOL	581785
Elurikkus	4247
Calflora (Californian flora)	2623
USDA GRIN	300172
Wikipedia	Daucus_carota
CMAUP	NPO163

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
GCF_001625215.2	DH1 v3.0	Chromosome	USDA ARS	2023-10-20	556.0x	420.30 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

Arbuscular mycorrhizal fungi and Streptomyces: brothers in arms to shape the structure and function of the hyphosphere microbiome in the early stage of interaction

Jin Z, Jiang F, Wang L, Declerck S, Feng G, Zhang L

Microbiome

09-May-2024

PMCID:	PMC11080229
doi:	10.1186/s40168-024-01811-2
PMID:	38725008

Study of medicinal plants used in ethnoveterinary medical system in riverine areas of Punjab, Pakistan

Umair M, Altaf M, Ahsan T, Bussmann RW, Abbasi AM, Gatasheh MK, Elrobh M

J Ethnobiol Ethnomed

07-May-2024

PMCID:	PMC11077875
doi:	10.1186/s13002-024-00686-9
PMID:	38715115

Comparative analysis of POD genes and their expression under multiple hormones in Pyrus bretschenedri

Li G, Manzoor MA, Wang G, Huang S, Ding X, Abdullah M, Zhang M, Song C

BMC Genom Data

06-May-2024

PMCID:	PMC11075270
doi:	10.1186/s12863-024-01229-7
PMID:	38711007

Application of Developmental Regulators for Enhancing Plant Regeneration and Genetic Transformation

Xu P, Zhong Y, Xu A, Liu B, Zhang Y, Zhao A, Yang X, Ming M, Cao F, Fu F

Plants (Basel)

04-May-2024

PMCID:	PMC11085514
doi:	10.3390/plants13091272
PMID:	38732487

Strategies, Achievements, and Potential Challenges of Plant and Microbial Chassis in the Biosynthesis of Plant Secondary Metabolites

Han T, Miao G

Molecules

02-May-2024

PMCID:	PMC11085123
doi:	10.3390/molecules29092106
PMID:	38731602

Chemical composition and biological activities of essential oils of seven Cultivated Apiaceae species

Önder S, Periz ÇD, Ulusoy S, Erbaş S, Önder D, Tonguç M

Sci Rep

02-May-2024

PMCID:	PMC11066118
doi:	10.1038/s41598-024-60810-3
PMID:	38698117

Intercropping on Mars: A promising system to optimise fresh food production in future martian colonies

Gonçalves R, Wamelink GW, van der Putten P, Evers JB

PLoS One

01-May-2024

PMCID:	PMC11062560
doi:	10.1371/journal.pone.0302149
PMID:	38691526

Synergistic Inhibition of Synbiotic Cultures among Lactobacilli and Plant Extracts against Vaginal Discharge Causing Candida albicans

Sookkhee S, Khamnoi P, Sastraruji T, Boonkum S, Wikan N, Nimlamool W

Nutrients

30-Apr-2024

PMCID:	PMC11085874
doi:	10.3390/nu16091372
PMID:	38732618

Temperature Effects on Expression Levels of hsp Genes in Eggs and Second-Stage Juveniles of Meloidogyne hapla Chitwood, 1949

Flis Ł, Malewski T, Dobosz R

Int J Mol Sci

29-Apr-2024

PMCID:	PMC11084963
doi:	10.3390/ijms25094867
PMID:	38732085

Overexpression of MsDREB1C Modulates Growth and Improves Forage Quality in Tetraploid Alfalfa (Medicago sativa L.)

Zhang Y, Wang Z, Zhang F, Wang X, Li Y, Long R, Li M, Li X, Wang Q, Yang Q, Kang J

Plants (Basel)

29-Apr-2024

PMCID:	PMC11085332
doi:	10.3390/plants13091237
PMID:	38732451

High potential extracts from cocoa byproducts through sonotrode optimal extraction and a comprehensive characterization

Ramos-Escudero F, Rojas-García A, Cádiz-Gurrea MD, Segura-Carretero A

Ultrason Sonochem

26-Apr-2024

PMCID:	PMC11070619
doi:	10.1016/j.ultsonch.2024.106887
PMID:	38696912

A systems biology-based mathematical model demonstrates the potential anti-stress effectiveness of a multi-nutrient botanical formulation

Saxena A, Prabhudesai KS, Damle A, Ramakrishnan S, Durairaj P, Kalankariyan S, Vijayalakshmi AB, Venkatesh KV

Sci Rep

26-Apr-2024

PMCID:	PMC11053000
doi:	10.1038/s41598-024-60112-8
PMID:	38671040

Insect floral visitors of thermo-Mediterranean shrubland maquis (Ajaccio, Corsica, France)

Maestracci PY, Plume L, Gibernau M

Biodivers Data J

25-Apr-2024

PMCID:	PMC11079593
doi:	10.3897/BDJ.12.e118614
PMID:	38726024

The mechanisms of natural products for eye disorders by targeting mitochondrial dysfunction

Sun GF, Qu XH, Jiang LP, Chen ZP, Wang T, Han XJ

Front Pharmacol

25-Apr-2024

PMCID:	PMC11079200
doi:	10.3389/fphar.2024.1270073
PMID:	38725662

IV-Range Carrot Waste Flour Enhances Nutritional and Functional Properties of Rice-Based Gluten-Free Muffins

Bas-Bellver C, Barrera C, Betoret N, Seguí L, Harasym J

Foods

24-Apr-2024

PMCID:	PMC11083371
doi:	10.3390/foods13091312
PMID:	38731683

Phytochemical Profile Top

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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 / Tropane alkaloids
[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] (Z)-2-methylbut-2-enoate	6540490	Click to see CC=C(C)C(=O)OC1CC2CCC(C1)N2C	223.31	unknown	via CMAUP database
> Benzenoids / Anthracenes / Anthraquinones
Fallacinol	3083633	Click to see COC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)CO	300.26	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives
Benzaldehyde, oxime, (Z)-	5324470	Click to see C1=CC=C(C=C1)C=NO	121.14	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Anilides / Aromatic anilides / Benzanilides
Carotamine	131752767	Click to see C1=CC(=CC=C1C(=O)NC2=CC(=C(C=C2)C(=O)O)N)N	271.27	unknown	https://doi.org/10.3390/70600501
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Aminobenzoic acids and derivatives / Aminobenzoic acids
2,4-Diaminobenzoic acid	69134	Click to see C1=CC(=C(C=C1N)N)C(=O)O	152.15	unknown	https://doi.org/10.3390/70600501
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives
4-Hydroxybenzoic acid	135	Click to see C1=CC(=CC=C1C(=O)O)O	138.12	unknown	https://doi.org/10.1007/BF00197054
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / P-methoxybenzoic acids and derivatives
(8a-Hydroxy-1,6-dimethyl-3-oxo-1,2,3a,4,7,8-hexahydroazulen-4-yl) 4-methoxybenzoate	163050548	Click to see CC1CC(=O)C2C1(CCC(=CC2OC(=O)C3=CC=C(C=C3)OC)C)O	344.40	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2005.05.010
[(1S,3aS,4R,8aS)-8a-hydroxy-1,6-dimethyl-3-oxo-1,2,3a,4,7,8-hexahydroazulen-4-yl] 4-methoxybenzoate	163189653	Click to see CC1CC(=O)C2C1(CCC(=CC2OC(=O)C3=CC=C(C=C3)OC)C)O	344.40	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2005.05.010
> Benzenoids / Benzene and substituted derivatives / Benzophenones
Benzophenone	3102	Click to see C1=CC=C(C=C1)C(=O)C2=CC=CC=C2	182.22	unknown	https://doi.org/10.1002/CBDV.201300390
> Benzenoids / Benzene and substituted derivatives / Benzoyl derivatives
2,4,5-Trimethoxybenzaldehyde	20525	Click to see COC1=CC(=C(C=C1C=O)OC)OC	196.20	unknown	https://doi.org/10.1021/JF020209R https://doi.org/10.1021/JO01057A538 https://doi.org/10.1021/JF034085+
Benzaldehyde	240	Click to see C1=CC=C(C=C1)C=O	106.12	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzyl alcohols
4-Hydroxybenzyl alcohol	125	Click to see C1=CC(=CC=C1CO)O	124.14	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Biphenyls and derivatives
Biphenyl	7095	Click to see C1=CC=C(C=C1)C2=CC=CC=C2	154.21	unknown	https://doi.org/10.1021/JF60160A012 https://doi.org/10.1021/JF60198A031
> Benzenoids / Benzene and substituted derivatives / Methoxybenzenes / Dimethoxybenzenes
Isoeugenyl methyl ether	1549045	Click to see CC=CC1=CC(=C(C=C1)OC)OC	178.23	unknown	via CMAUP database
Methyl isoeugenol	7128	Click to see CC=CC1=CC(=C(C=C1)OC)OC	178.23	unknown	via CMAUP database
Methyleugenol	7127	Click to see COC1=C(C=C(C=C1)CC=C)OC	178.23	unknown	https://doi.org/10.1016/0031-6865(94)00054-Y https://doi.org/10.1271/NOGEIKAGAKU1924.63.185
Methylisoeugenol	637776	Click to see CC=CC1=CC(=C(C=C1)OC)OC	178.23	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Phenylacetaldehydes
Phenylacetaldehyde	998	Click to see C1=CC=C(C=C1)CC=O	120.15	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	https://doi.org/10.1021/JF60221A041
> Benzenoids / Benzene and substituted derivatives / Phenylpropenes
1-Methyl-4-(prop-1-en-2-yl)benzene	62385	Click to see CC1=CC=C(C=C1)C(=C)C	132.20	unknown	https://doi.org/10.1021/JF60221A041
> Benzenoids / Naphthalenes
N-Phenyl-2-naphthylamine	8679	Click to see C1=CC=C(C=C1)NC2=CC3=CC=CC=C3C=C2	219.28	unknown	via CMAUP database
> Benzenoids / Phenol ethers / Anisoles
alpha-Asarone	636822	Click to see CC=CC1=CC(=C(C=C1OC)OC)OC	208.25	unknown	https://doi.org/10.1021/JF020209R https://doi.org/10.1271/NOGEIKAGAKU1924.63.185 https://doi.org/10.1248/YAKUSHI1881.1926.538_1003
Azaron	17903	Click to see CC=CC1=CC(=C(C=C1OC)OC)OC	208.25	unknown	https://doi.org/10.1248/YAKUSHI1881.1926.538_1003 https://doi.org/10.1021/JF020209R
beta-Asarone	5281758	Click to see CC=CC1=CC(=C(C=C1OC)OC)OC	208.25	unknown	https://doi.org/10.1271/NOGEIKAGAKU1924.63.185 https://doi.org/10.1016/0031-6865(94)00054-Y
Elemicin	10248	Click to see COC1=CC(=CC(=C1OC)OC)CC=C	208.25	unknown	https://doi.org/10.1021/JF60221A041
> Benzenoids / Phenols / 1-hydroxy-2-unsubstituted benzenoids
4-Allylphenol	68148	Click to see C=CCC1=CC=C(C=C1)O	134.17	unknown	via CMAUP database
> Benzenoids / Phenols / Methoxyphenols
2-Methoxy-4-vinylphenol	332	Click to see COC1=C(C=CC(=C1)C=C)O	150.17	unknown	https://doi.org/10.1021/JF60221A041
5-Ethenyl-2-methoxyphenol	10441857	Click to see COC1=C(C=C(C=C1)C=C)O	150.17	unknown	https://doi.org/10.1021/JF60221A041
6-Methylisoeugenol	45266886	Click to see CC=CC1=CC(=C(C(=C1)C)O)OC	178.23	unknown	https://doi.org/10.1002/CBDV.201300390
Eugenol	3314	Click to see COC1=C(C=CC(=C1)CC=C)O	164.20	unknown	https://doi.org/10.1271/NOGEIKAGAKU1924.63.185 https://doi.org/10.1021/JF60221A041
> Benzenoids / Tetralins
alpha-Ionene	68057	Click to see CC1=CC2=C(C=C1)C(CCC2)(C)C	174.28	unknown	https://doi.org/10.1021/JF60198A031
> Hydrocarbons / Polycyclic hydrocarbons
beta-Patchoulene	101731	Click to see CC1CCC2=C1CC3CCC2(C3(C)C)C	204.35	unknown	via CMAUP database
> Hydrocarbons / Saturated hydrocarbons / Alkanes
Pentadecane	12391	Click to see CCCCCCCCCCCCCCC	212.41	unknown	via CMAUP database
Tridecane	12388	Click to see CCCCCCCCCCCCC	184.36	unknown	via CMAUP database
> Hydrocarbons / Unsaturated hydrocarbons / Branched unsaturated hydrocarbons
(-)-beta-Acoradiene	91751401	Click to see CC1CCC(C12CCC(=CC2)C)C(=C)C	204.35	unknown	via CMAUP database
(1R,4S,5R)-1,8-Dimethyl-4-(prop-1-en-2-yl)spiro[4.5]dec-7-ene	20055537	Click to see CC1CCC(C12CCC(=CC2)C)C(=C)C	204.35	unknown	via CMAUP database
beta-Acoradiene	6428280	Click to see CC1CCC(C12CCC(=CC2)C)C(=C)C	204.35	unknown	via CMAUP database
gamma-Terpinene	7461	Click to see CC1=CCC(=CC1)C(C)C	136.23	unknown	https://doi.org/10.1016/S0031-9422(00)81741-0 https://doi.org/10.1016/0031-9422(82)80129-5 https://doi.org/10.1021/JF60198A031 https://doi.org/10.1021/JF60160A012
> Lignans, neolignans and related compounds / Dibenzylbutane lignans / Dibenzylbutanediol lignans
Secoisolariciresinol	65373	Click to see COC1=C(C=CC(=C1)CC(CO)C(CC2=CC(=C(C=C2)O)OC)CO)O	362.40	unknown	https://doi.org/10.1016/J.FOODCHEM.2009.03.002
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Branched fatty acids / Methyl-branched fatty acids
2,3-Dimethylacrylic acid, (E)-	125468	Click to see CC=C(C)C(=O)O	100.12	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2005.04.005
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids
9-Octadecenoic acid	965	Click to see CCCCCCCCC=CCCCCCCCC(=O)O	282.50	unknown	https://doi.org/10.1021/JF020209R
Myristelaidic acid	5312402	Click to see CCCCC=CCCCCCCCC(=O)O	226.35	unknown	via CMAUP database
Oleic Acid	445639	Click to see CCCCCCCCC=CCCCCCCCC(=O)O	282.50	unknown	https://doi.org/10.1021/JF020209R
Petroselinic acid	5281125	Click to see CCCCCCCCCCCC=CCCCCC(=O)O	282.50	unknown	https://doi.org/10.1016/S0031-9422(00)90351-0 https://doi.org/10.1007/BF02540408
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Straight chain fatty acids
2-Butenoic acid	19499	Click to see CC=CC(=O)O	86.09	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2005.04.005
Crotonic acid	637090	Click to see CC=CC(=O)O	86.09	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2005.04.005
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohol esters
[(3S,8S,9Z)-8-hydroxyheptadeca-1,9-dien-4,6-diyn-3-yl] acetate	92033992	Click to see CCCCCCCC=CC(C#CC#CC(C=C)OC(=O)C)O	302.40	unknown	https://doi.org/10.1021/JF073494T https://doi.org/10.1021/JF034085+
8-Hydroxyheptadeca-1,9-dien-4,6-diyn-3-yl acetate	162988599	Click to see CCCCCCCC=CC(C#CC#CC(C=C)OC(=O)C)O	302.40	unknown	https://doi.org/10.1021/JF073494T https://doi.org/10.1021/JF034085+
Geranyl 2-methylbutyrate	6437648	Click to see CCC(C)C(=O)OCC=C(C)CCC=C(C)C	238.37	unknown	https://doi.org/10.1021/JF60221A041
Geranyl acetate	1549026	Click to see CC(=CCCC(=CCOC(=O)C)C)C	196.29	unknown	https://doi.org/10.1002/FFJ.2730040414
Geranyl isobutyrate	6086514	Click to see CC(C)C(=O)OCC=C(C)CCC=C(C)C	224.34	unknown	https://doi.org/10.1021/JF60221A041
Neryl acetate	1549025	Click to see CC(=CCCC(=CCOC(=O)C)C)C	196.29	unknown	https://doi.org/10.1002/CBDV.201300390
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols
(S)-(+)-6-Methyl-5-hepten-2-OL	6971127	Click to see CC(CCC=C(C)C)O	128.21	unknown	via CMAUP database
1-Hexanol	8103	Click to see CCCCCCO	102.17	unknown	https://doi.org/10.1002/CBDV.201300390
6-Methylhept-5-en-2-ol	20745	Click to see CC(CCC=C(C)C)O	128.21	unknown	https://doi.org/10.1002/CBDV.201300390
Falcarinolone	6442185	Click to see CCCCCCCC=CC(C#CC#CC(=O)C=C)O	258.35	unknown	https://doi.org/10.1016/0031-9422(92)83739-L
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols / Long-chain fatty alcohols
(3R,8S,9E)-heptadeca-1,9-dien-4,6-diyne-3,8-diol	56935895	Click to see CCCCCCCC=CC(C#CC#CC(C=C)O)O	260.40	unknown	via CMAUP database
(3S,8R)-heptadeca-1,9-dien-4,6-diyne-3,8-diol	131954651	Click to see CCCCCCCC=CC(C#CC#CC(C=C)O)O	260.40	unknown	https://doi.org/10.1007/BF01012274 https://doi.org/10.1021/JF00110A025
(E,R)-Heptadeca-1,9-dien-4,6-diyne-3-ol	56935896	Click to see CCCCCCCC=CCC#CC#CC(C=C)O	244.37	unknown	https://doi.org/10.1021/JF60220A043 https://doi.org/10.1007/BF01012274 https://doi.org/10.1021/JF00110A025
1,9-Heptadecadiene-4,6-diyne-3,8-diol	6436239	Click to see CCCCCCCC=CC(C#CC#CC(C=C)O)O	260.40	unknown	https://doi.org/10.1021/JF034085+ https://doi.org/10.1021/JF073494T
Falcarindiol	5281148	Click to see CCCCCCCC=CC(C#CC#CC(C=C)O)O	260.40	unknown	https://doi.org/10.1007/BF01012274 https://doi.org/10.1021/JF00110A025
Falcarinol	5281149	Click to see CCCCCCCC=CCC#CC#CC(C=C)O	244.37	unknown	https://doi.org/10.1021/JF60220A043 https://doi.org/10.1007/BF01012274 https://doi.org/10.1021/JF073494T https://doi.org/10.1021/JF00110A025
Heptadeca-1,9-dien-4,6-diyn-3-ol	3322	Click to see CCCCCCCC=CCC#CC#CC(C=C)O	244.37	unknown	https://doi.org/10.1021/JF073494T https://doi.org/10.1021/JF034085+
Heptadeca-1,9-dien-4,6-diyne-3,8-diol	3321	Click to see CCCCCCCC=CC(C#CC#CC(C=C)O)O	260.40	unknown	https://doi.org/10.1021/JF073494T https://doi.org/10.1021/JF034085+
Panaxynol	5469789	Click to see CCCCCCCC=CCC#CC#CC(C=C)O	244.37	unknown	https://doi.org/10.1021/JF034085+
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids
2H-2,4a-Methanonaphthalene, 1,3,4,5,6,7-hexahydro-1,1,5,5-tetramethyl-, (2S)-	102562	Click to see CC1(CCC=C2C13CCC(C3)C2(C)C)C	204.35	unknown	https://doi.org/10.1002/CBDV.201300390
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids
(+)-Linalyl acetate	6999980	Click to see CC(=CCCC(C)(C=C)OC(=O)C)C	196.29	unknown	via CMAUP database
(Z)-Tagetenone	6428432	Click to see CC(=CC(=O)C=C(C)C=C)C	150.22	unknown	https://doi.org/10.1002/CBDV.201300390
3,7-Dimethyl-2,6-octadien-1-ol	4458	Click to see CC(=CCCC(=CCO)C)C	154.25	unknown	https://doi.org/10.1021/JF020209R
beta-OCIMENE, (3E)-	5281553	Click to see CC(=CCC=C(C)C=C)C	136.23	unknown	https://doi.org/10.1021/JF980108M
beta-Ocimene, (3Z)-	5320250	Click to see CC(=CCC=C(C)C=C)C	136.23	unknown	https://doi.org/10.1021/JF980108M https://doi.org/10.1002/CBDV.201300390
Citral	638011	Click to see CC(=CCCC(=CC=O)C)C	152.23	unknown	via CMAUP database
Geraniol	637566	Click to see CC(=CCCC(=CCO)C)C	154.25	unknown	https://doi.org/10.1021/JF020209R https://doi.org/10.1016/0031-9422(74)85009-0
Geranylacetone	1549778	Click to see CC(=CCCC(=CCCC(=O)C)C)C	194.31	unknown	https://doi.org/10.1021/JF60221A041
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/10.1021/JF60198A031
Linalyl acetate	8294	Click to see CC(=CCCC(C)(C=C)OC(=O)C)C	196.29	unknown	https://doi.org/10.1002/CBDV.201300390
Linalyl acetate, (-)-	442474	Click to see CC(=CCCC(C)(C=C)OC(=O)C)C	196.29	unknown	via CMAUP database
Myrcene	31253	Click to see CC(=CCCC(=C)C=C)C	136.23	unknown	https://doi.org/10.1016/S0031-9422(00)81741-0 https://doi.org/10.1016/0031-9422(82)80129-5 https://doi.org/10.1021/JF60160A012 https://doi.org/10.1021/JF60198A031 https://doi.org/10.1021/JF980108M
Neral	643779	Click to see CC(=CCCC(=CC=O)C)C	152.23	unknown	via CMAUP database
Nerol	643820	Click to see CC(=CCCC(=CCO)C)C	154.25	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Aromatic monoterpenoids
2-(4-Methylphenyl)propan-1-ol	95376	Click to see CC1=CC=C(C=C1)C(C)CO	150.22	unknown	https://doi.org/10.1002/CBDV.201300390
4-Isopropylbenzyl alcohol	325	Click to see CC(C)C1=CC=C(C=C1)CO	150.22	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
Cuminaldehyde	326	Click to see CC(C)C1=CC=C(C=C1)C=O	148.20	unknown	https://doi.org/10.1002/CBDV.201300390
p-CYMENE	7463	Click to see CC1=CC=C(C=C1)C(C)C	134.22	unknown	https://doi.org/10.1021/JF60160A012 https://doi.org/10.1021/JF60198A031
Thymol	6989	Click to see CC1=CC(=C(C=C1)C(C)C)O	150.22	unknown	via CMAUP database
> 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
(-)-beta-Pinene	440967	Click to see CC1(C2CCC(=C)C1C2)C	136.23	unknown	https://doi.org/10.1016/0031-9422(82)80129-5
(-)-Camphene	440966	Click to see CC1(C2CCC(C2)C1=C)C	136.23	unknown	via CMAUP database
(-)-cis-Sabinol	42626427	Click to see CC(C)C12CC1C(=C)C(C2)O	152.23	unknown	via CMAUP database
(-)-Myrtenal	1201529	Click to see CC1(C2CC=C(C1C2)C=O)C	150.22	unknown	via CMAUP database
(-)-Myrtenyl acetate	12635160	Click to see CC(=O)OCC1=CCC2CC1C2(C)C	194.27	unknown	via CMAUP database
(-)-Sabinene	11051711	Click to see CC(C)C12CCC(=C)C1C2	136.23	unknown	via CMAUP database
(-)-trans-Myrtanol	104476	Click to see CC1(C2CCC(C1C2)CO)C	154.25	unknown	via CMAUP database
(-)-Verbenone	92874	Click to see CC1=CC(=O)C2CC1C2(C)C	150.22	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
(+)-trans-Myrtanol	84880	Click to see CC1(C2CCC(C1C2)CO)C	154.25	unknown	via CMAUP database
(1R,2S,4R)-(+)-Bornyl acetate	443131	Click to see CC(=O)OC1CC2CCC1(C2(C)C)C	196.29	unknown	via CMAUP database
(1r,3s,5r)-6,6-Dimethyl-2-methylidenebicyclo[3.1.1]heptan-3-ol	88302	Click to see CC1(C2CC1C(=C)C(C2)O)C	152.23	unknown	via CMAUP database
(1R,4R)-1,7,7-Trimethylbicyclo[2.2.1]heptan-2-OL	12242824	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
(1R,5R)-2,6-dimethyl-6-(4-methylpent-3-enyl)bicyclo[3.1.1]hept-2-ene	91753502	Click to see CC1=CCC2CC1C2(C)CCC=C(C)C	204.35	unknown	via CMAUP database
(1R,5R)-6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptan-3-one	10012081	Click to see CC1(C2CC1C(=C)C(=O)C2)C	150.22	unknown	via CMAUP database
(1S,2R,4S)-(-)-Bornyl acetate	442460	Click to see CC(=O)OC1CC2CCC1(C2(C)C)C	196.29	unknown	via CMAUP database
(1S,2R,5S)-4,6,6-trimethylbicyclo[3.1.1]hept-3-en-2-ol	88298	Click to see CC1=CC(C2CC1C2(C)C)O	152.23	unknown	https://doi.org/10.1002/CBDV.201300390
(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,3R,5S)-6,6-Dimethyl-2-methylenebicyclo[3.1.1]heptan-3-ol	12314318	Click to see CC1(C2CC1C(=C)C(C2)O)C	152.23	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
(6,6-Dimethylbicyclo(3.1.1)hept-2-en-2-yl)methyl acetate	61262	Click to see CC(=O)OCC1=CCC2CC1C2(C)C	194.27	unknown	via CMAUP database
(S)-cis-Verbenol	87839	Click to see CC1=CC(C2CC1C2(C)C)O	152.23	unknown	via CMAUP database
[(1S,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] acetate	57505377	Click to see CC(=O)OC1CC2CCC1(C2(C)C)C	196.29	unknown	via CMAUP database
[(2S)-4,6,6-trimethyl-2-bicyclo[3.1.1]hept-3-enyl] acetate	12988039	Click to see CC1=CC(C2CC1C2(C)C)OC(=O)C	194.27	unknown	via CMAUP database
1-Isopropyl-4-methylenebicyclo[3.1.0]hex-2-ene	524198	Click to see CC(C)C12CC1C(=C)C=C2	134.22	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	https://doi.org/10.1016/S0031-9422(00)81741-0 https://doi.org/10.1021/JF60198A031 https://doi.org/10.1021/JF60160A012
2,10-Epoxypinane	93046	Click to see CC1(C2CCC3(C1C2)CO3)C	152.23	unknown	via CMAUP database
3-Carene	26049	Click to see CC1=CCC2C(C1)C2(C)C	136.23	unknown	https://doi.org/10.1271/NOGEIKAGAKU1924.63.185
3-Pinanone	11038	Click to see CC1C2CC(C2(C)C)CC1=O	152.23	unknown	via CMAUP database
3-Thujanone	11027	Click to see CC1C2CC2(CC1=O)C(C)C	152.23	unknown	via CMAUP database
5-Isopropylbicyclo[3.1.0]hex-2-ene-2-carbaldehyde	530411	Click to see CC(C)C12CC=C(C1C2)C=O	150.22	unknown	via CMAUP database
alpha-Bergamotene	86608	Click to see CC1=CCC2CC1C2(C)CCC=C(C)C	204.35	unknown	https://doi.org/10.1021/JF60215A043
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/10.1016/S0031-9422(00)81741-0 https://doi.org/10.1002/(SICI)1099-1026(199909/10)14:5<268::AID-FFJ823>3.0.CO;2-Z https://doi.org/10.1002/FFJ.2730040414 https://doi.org/10.1021/JF60160A012 https://doi.org/10.1021/JF60198A031 https://doi.org/10.1021/JF980108M
alpha-Pinene oxide	91508	Click to see CC1(C2CC1C3(C(C2)O3)C)C	152.23	unknown	https://doi.org/10.1002/CBDV.201300390
alpha-Thujone	12304613	Click to see CC1C2CC2(CC1=O)C(C)C	152.23	unknown	via CMAUP database
beta-Fenchyl alcohol	6973643	Click to see CC1(C2CCC(C2)(C1O)C)C	154.25	unknown	via CMAUP database
beta-Pinene	14896	Click to see CC1(C2CCC(=C)C1C2)C	136.23	unknown	https://doi.org/10.1016/S0031-9422(00)81741-0 https://doi.org/10.1016/0031-9422(82)80129-5 https://doi.org/10.1021/JF60160A012 https://doi.org/10.1021/JF60198A031 https://doi.org/10.1021/JF980108M
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	via CMAUP database
Bicyclo[3.1.0]hexan-3-ol, 4-methylene-1-(1-methylethyl)-, [1S-(1alpha,3alpha,5alpha)]-(9CI)	12315160	Click to see CC(C)C12CC1C(=C)C(C2)O	152.23	unknown	via CMAUP database
Bicyclo[3.1.1]hept-3-en-2-ol, 4,6,6-trimethyl-, [1S-(1alpha,2beta,5alpha)]-	2734021	Click to see CC1=CC(C2CC1C2(C)C)O	152.23	unknown	via CMAUP database
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
Bornyl acetate	6448	Click to see CC(=O)OC1CC2CCC1(C2(C)C)C	196.29	unknown	https://doi.org/10.1016/S0031-9422(00)81741-0 https://doi.org/10.1021/JF60160A012 https://doi.org/10.1021/JF60198A031 https://doi.org/10.1016/0031-9422(82)80129-5
Camphene	6616	Click to see CC1(C2CCC(C2)C1=C)C	136.23	unknown	https://doi.org/10.1021/JF60160A012 https://doi.org/10.1021/JF60198A031
CID 44630107	44630107	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	https://doi.org/10.1021/JF60198A031
cis-Verbenol	164888	Click to see CC1=CC(C2CC1C2(C)C)O	152.23	unknown	via CMAUP database
cis-Verbenyl acetate	6427494	Click to see CC1=CC(C2CC1C2(C)C)OC(=O)C	194.27	unknown	https://doi.org/10.1002/CBDV.201300390
d-Isothujone	249286	Click to see CC1C2CC2(CC1=O)C(C)C	152.23	unknown	via CMAUP database
DL-2-Bornanol	10049	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
DL-Borneol	10492	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
endo-2-Bornanol	439568	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
Exo-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl acetate	6950273	Click to see CC(=O)OC1CC2CCC1(C2(C)C)C	196.29	unknown	via CMAUP database
Fenchol, exo-	71300291	Click to see CC1(C2CCC(C2)(C1O)C)C	154.25	unknown	via CMAUP database
Isobornyl acetate	247573	Click to see CC(=O)OC1CC2CCC1(C2(C)C)C	196.29	unknown	via CMAUP database
Myrtenal	61130	Click to see CC1(C2CC=C(C1C2)C=O)C	150.22	unknown	via CMAUP database
Myrtenol	10582	Click to see CC1(C2CC=C(C1C2)CO)C	152.23	unknown	via CMAUP database
Myrtenol, (-)-	88301	Click to see CC1(C2CC=C(C1C2)CO)C	152.23	unknown	via CMAUP database
Nopol	31408	Click to see CC1(C2CC=C(C1C2)CCO)C	166.26	unknown	https://doi.org/10.1021/JF60198A031
Pichtosin	637531	Click to see CC(=O)OC1CC2CCC1(C2(C)C)C	196.29	unknown	https://doi.org/10.1016/0031-9422(82)80129-5
Pichtosine	61061	Click to see CC(=O)OC1CC2CCC1(C2(C)C)C	196.29	unknown	via CMAUP database
Pinocarveol	102667	Click to see CC1(C2CC1C(=C)C(C2)O)C	152.23	unknown	https://doi.org/10.1002/CBDV.201300390
Pinocarveol, trans-(-)-	1201530	Click to see CC1(C2CC1C(=C)C(C2)O)C	152.23	unknown	via CMAUP database
Pinocarvone	121719	Click to see CC1(C2CC1C(=C)C(=O)C2)C	150.22	unknown	via CMAUP database
Pinocarvyl acetate	102553	Click to see CC(=O)OC1CC2CC(C1=C)C2(C)C	194.27	unknown	via CMAUP database
Pinocarvyl acetate, trans-(-)-	12858461	Click to see CC(=O)OC1CC2CC(C1=C)C2(C)C	194.27	unknown	via CMAUP database
Sabinen	18818	Click to see CC(C)C12CCC(=C)C1C2	136.23	unknown	https://doi.org/10.1016/0031-9422(82)80129-5 https://doi.org/10.1021/JF60160A012 https://doi.org/10.1021/JF980108M
Sabinene	10887971	Click to see CC(C)C12CCC(=C)C1C2	136.23	unknown	https://doi.org/10.1016/0031-9422(82)80129-5
Sabinene hydrate	62367	Click to see CC(C)C12CCC(C1C2)(C)O	154.25	unknown	via CMAUP database
Sabinol	94147	Click to see CC(C)C12CC1C(=C)C(C2)O	152.23	unknown	via CMAUP database
Sumatra camphor	657014	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
trans-Sabinol	6429076	Click to see CC(C)C12CC1C(=C)C(C2)O	152.23	unknown	https://doi.org/10.1002/CBDV.201300390
trans-Sabinyl acetate	6430313	Click to see CC(C)C12CC1C(=C)C(C2)OC(=O)C	194.27	unknown	https://doi.org/10.1002/CBDV.201300390
trans-Thujone	6432452	Click to see CC1C2CC2(CC1=O)C(C)C	152.23	unknown	via CMAUP database
trans-Verbenol	89664	Click to see CC1=CC(C2CC1C2(C)C)O	152.23	unknown	via CMAUP database
Tricyclene	79035	Click to see CC1(C2CC3C1(C3C2)C)C	136.23	unknown	via CMAUP database
Umbellulone	91195	Click to see CC1=CC(=O)C2(C1C2)C(C)C	150.22	unknown	https://doi.org/10.1002/CBDV.201300390
Umbellulone	442504	Click to see CC1=CC(=O)C2(C1C2)C(C)C	150.22	unknown	via CMAUP database
Verbenol	61126	Click to see CC1=CC(C2CC1C2(C)C)O	152.23	unknown	via CMAUP database
Verbenone	29025	Click to see CC1=CC(=O)C2CC1C2(C)C	150.22	unknown	via CMAUP database
Verbenone, (+)-	65724	Click to see CC1=CC(=O)C2CC1C2(C)C	150.22	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Iridoids and derivatives
(+)-Isoitalicene	10987385	Click to see CC1CCC2C13CCC(=CC3C2(C)C)C	204.35	unknown	via CMAUP database
Italicene	15690922	Click to see CC1CCC2C13CCC(=CC3C2(C)C)C	204.35	unknown	via CMAUP database
Italicene epoxide	91704566	Click to see CC1CCC2C13CCC4(C(C3C2(C)C)O4)C	220.35	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	via CMAUP database
(-)-cis-Carveol	330573	Click to see CC1=CCC(CC1O)C(=C)C	152.23	unknown	via CMAUP database
(-)-Pulegone	638012	Click to see CC1CCC(=C(C)C)C(=O)C1	152.23	unknown	via CMAUP database
(-)-Terpinen-4-ol	5325830	Click to see CC1=CCC(CC1)(C(C)C)O	154.25	unknown	via CMAUP database
(-)-trans-Carveol	94221	Click to see CC1=CCC(CC1O)C(=C)C	152.23	unknown	via CMAUP database
(+)-alpha-Phellandrene	443160	Click to see CC1=CCC(C=C1)C(C)C	136.23	unknown	https://doi.org/10.1016/0031-9422(82)80129-5
(+)-cis-Carveol	443177	Click to see CC1=CCC(CC1O)C(=C)C	152.23	unknown	via CMAUP database
(+)-Piperitone	61362	Click to see CC1=CC(=O)C(CC1)C(C)C	152.23	unknown	via CMAUP database
(+)-Terpinen-4-ol	2724161	Click to see CC1=CCC(CC1)(C(C)C)O	154.25	unknown	via CMAUP database
(+)-trans-Carveol	443178	Click to see CC1=CCC(CC1O)C(=C)C	152.23	unknown	via CMAUP database
(1r,4r)-1-Methyl-4-(prop-1-en-2-yl)cyclohex-2-en-1-ol	111274	Click to see CC(=C)C1CCC(C=C1)(C)O	152.23	unknown	via CMAUP database
(1S,4R)-1-methyl-4-(prop-1-en-2-yl)cyclohex-2-enol	11105550	Click to see CC(=C)C1CCC(C=C1)(C)O	152.23	unknown	via CMAUP database
(Z)-p-Menth-2-en-1-ol	13918681	Click to see CC(C)C1CCC(C=C1)(C)O	154.25	unknown	via CMAUP database
1,3-p-Menthadien-7-al	526762	Click to see CC(C)C1=CC=C(CC1)C=O	150.22	unknown	via CMAUP database
2-Cyclohexen-1-ol, 1-methyl-4-(1-methylethenyl)-, trans-	12618691	Click to see CC(=C)C1CCC(C=C1)(C)O	152.23	unknown	via CMAUP database
2-Cyclohexen-1-ol, 1-methyl-4-(1-methylethyl)-, trans-	122484	Click to see CC(C)C1CCC(C=C1)(C)O	154.25	unknown	via CMAUP database
2-Cyclohexen-1-one, 6-methyl-3-(1-methylethyl)-	10363	Click to see CC1CCC(=CC1=O)C(C)C	152.23	unknown	via CMAUP database
4-Terpineol, (+/-)-	11230	Click to see CC1=CCC(CC1)(C(C)C)O	154.25	unknown	https://doi.org/10.1021/JF60198A031 https://doi.org/10.1021/JF60160A012
alpha-PHELLANDRENE	7460	Click to see CC1=CCC(C=C1)C(C)C	136.23	unknown	https://doi.org/10.1016/S0031-9422(00)81741-0 https://doi.org/10.1016/0031-9422(82)80129-5
alpha-Terpinene	7462	Click to see CC1=CC=C(CC1)C(C)C	136.23	unknown	https://doi.org/10.1016/S0031-9422(00)81741-0 https://doi.org/10.1016/0031-9422(82)80129-5 https://doi.org/10.1021/JF60198A031 https://doi.org/10.1021/JF60160A012
Alpha-Terpineol	17100	Click to see CC1=CCC(CC1)C(C)(C)O	154.25	unknown	https://doi.org/10.1021/JF60160A012 https://doi.org/10.1021/JF60198A031
alpha-Terpinyl acetate	111037	Click to see CC1=CCC(CC1)C(C)(C)OC(=O)C	196.29	unknown	via CMAUP database
Beta-Phellandrene	11142	Click to see CC(C)C1CCC(=C)C=C1	136.23	unknown	via CMAUP database
Carvone, (-)-	439570	Click to see CC1=CCC(CC1=O)C(=C)C	150.22	unknown	via CMAUP database
Carvone, (+)-	16724	Click to see CC1=CCC(CC1=O)C(=C)C	150.22	unknown	via CMAUP database
Carvone, (+/-)-	7439	Click to see CC1=CCC(CC1=O)C(=C)C	150.22	unknown	via CMAUP database
cis-4-(Isopropyl)-1-methylcyclohex-2-en-1-ol	122485	Click to see CC(C)C1CCC(C=C1)(C)O	154.25	unknown	via CMAUP database
Delta-Terpineol	81722	Click to see CC(C)(C1CCC(=C)CC1)O	154.25	unknown	https://doi.org/10.1002/CBDV.201300390
Dihydrocarvyl acetate	30248	Click to see CC1CCC(CC1OC(=O)C)C(=C)C	196.29	unknown	https://doi.org/10.1002/CBDV.201300390
Dihydrocarvyl acetate, (-)-	6553874	Click to see CC1CCC(CC1OC(=O)C)C(=C)C	196.29	unknown	via CMAUP database
l-Piperitone	107561	Click to see CC1=CC(=O)C(CC1)C(C)C	152.23	unknown	via CMAUP database
Limonene, (-)-	439250	Click to see CC1=CCC(CC1)C(=C)C	136.23	unknown	via CMAUP database
Limonene, (+)-	440917	Click to see CC1=CCC(CC1)C(=C)C	136.23	unknown	https://doi.org/10.1016/0031-9422(82)80129-5
Limonene, (+/-)-	22311	Click to see CC1=CCC(CC1)C(=C)C	136.23	unknown	https://doi.org/10.1016/S0031-9422(00)81741-0 https://doi.org/10.1016/0031-9422(82)80129-5 https://doi.org/10.1021/JF60160A012 https://doi.org/10.1021/JF980108M
p-Menth-3-en-1-ol	11468	Click to see CC(C)C1=CCC(CC1)(C)O	154.25	unknown	via CMAUP database
p-Menth-4(8)-en-3-one	6988	Click to see CC1CCC(=C(C)C)C(=O)C1	152.23	unknown	via CMAUP database
p-Mentha-1,3,8-triene	176983	Click to see CC1=CC=C(CC1)C(=C)C	134.22	unknown	via CMAUP database
p-Mentha-1,5-dien-8-ol	519323	Click to see CC1=CCC(C=C1)C(C)(C)O	152.23	unknown	via CMAUP database
P-Mentha-2,8-dien-1-ol	155626	Click to see CC(=C)C1CCC(C=C1)(C)O	152.23	unknown	via CMAUP database
Phellandral	89488	Click to see CC(C)C1CCC(=CC1)C=O	152.23	unknown	https://doi.org/10.1002/CBDV.201300390
Piperitenone	381152	Click to see CC1=CC(=O)C(=C(C)C)CC1	150.22	unknown	via CMAUP database
Piperitone	6987	Click to see CC1=CC(=O)C(CC1)C(C)C	152.23	unknown	via CMAUP database
Pulegone	442495	Click to see CC1CCC(=C(C)C)C(=O)C1	152.23	unknown	via CMAUP database
Terpinolene	11463	Click to see CC1=CCC(=C(C)C)CC1	136.23	unknown	https://doi.org/10.1016/S0031-9422(00)81741-0 https://doi.org/10.1016/0031-9422(82)80129-5 https://doi.org/10.1016/0031-9422(82)80084-8 https://doi.org/10.1021/JF60198A031 https://doi.org/10.1021/JF60160A012
trans-(-)-p-Menth-1-en-3-ol	12314336	Click to see CC1=CC(C(CC1)C(C)C)O	154.25	unknown	via CMAUP database
trans-Piperitol	85568	Click to see CC1=CC(C(CC1)C(C)C)O	154.25	unknown	https://doi.org/10.1002/CBDV.201300390
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Monocyclic monoterpenoids
2-(2,2,3-Trimethylcyclopent-3-en-1-yl)acetaldehyde	98497	Click to see CC1=CCC(C1(C)C)CC=O	152.23	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
(-)-alpha-Amorphene	12306052	Click to see CC1=CC2C(CC1)C(=CCC2C(C)C)C	204.35	unknown	via CMAUP database
(-)-beta-Bourbonene	324224	Click to see CC(C)C1CCC2(C1C3C2CCC3=C)C	204.35	unknown	https://doi.org/10.1016/0031-6865(94)00054-Y
(-)-beta-Curcumene	14014430	Click to see CC1=CCC(=CC1)C(C)CCC=C(C)C	204.35	unknown	via CMAUP database
(-)-Longifolene	1201520	Click to see CC1(CCCC2(C3C1C(C2=C)CC3)C)C	204.35	unknown	via CMAUP database
(+)-alpha-Muurolene	12306049	Click to see CC1=CC2C(CC1)C(=CCC2C(C)C)C	204.35	unknown	via CMAUP database
(+)-delta-Cadinene	441005	Click to see CC1=CC2C(CCC(=C2CC1)C)C(C)C	204.35	unknown	https://doi.org/10.1002/CBDV.201300390
(+)-Epi-beta-Santalene	91746538	Click to see CC(=CCCC1(C2CCC(C2)C1=C)C)C	204.35	unknown	via CMAUP database
(+)-Longifolene	1796220	Click to see CC1(CCCC2(C3C1C(C2=C)CC3)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
(1-Acetyloxy-8-benzoyloxy-3-hydroxy-6,8a-dimethyl-3-propan-2-yl-1,2,3a,4,5,8-hexahydroazulen-4-yl) 4-methylbenzoate	163066013	Click to see CC1=CC(C2(C(CC(C2C(C1)OC(=O)C3=CC=C(C=C3)C)(C(C)C)O)OC(=O)C)C)OC(=O)C4=CC=CC=C4	534.60	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2005.05.010
(1R,4aR,8aR)-1,4a-dimethyl-7-propan-2-ylidene-3,4,5,6,8,8a-hexahydro-2H-naphthalen-1-ol	5318734	Click to see CC(=C1CCC2(CCCC(C2C1)(C)O)C)C	222.37	unknown	via CMAUP database
(1S,2R)-2-methyl-5-[(2R)-6-methylhept-5-en-2-yl]bicyclo[3.1.0]hexan-2-ol	91753540	Click to see CC(CCC=C(C)C)C12CCC(C1C2)(C)O	222.37	unknown	via CMAUP database
(1S,4S,4aR)-4-methyl-7-methylidene-1-propan-2-yl-2,3,4,4a,5,6-hexahydro-1H-naphthalene	11030951	Click to see CC1CCC(C2=CC(=C)CCC12)C(C)C	204.35	unknown	via CMAUP database
(1S,6R,9R)-6,10,10-trimethyl-2-methylidenebicyclo[7.2.0]undecane	162940691	Click to see CC1CCCC(=C)C2CC(C2CC1)(C)C	206.37	unknown	https://doi.org/10.1016/0031-9422(82)80084-8
(1S,7S)-3,3,7-trimethyl-8-methylidenetricyclo[5.4.0.02,9]undecane	10137	Click to see CC1(CCCC2(C3C1C(C2=C)CC3)C)C	204.35	unknown	via CMAUP database
(2R,3R,4aR,6aS,6aS,6bS,8aS,9R,12aS,14aS,14bR)-4,4,6a,6b,10,10,12a,14b-octamethyl-1,2,3,4a,5,6,6a,7,8,8a,9,11,12,13,14,14a-hexadecahydropicene-2,3,9-triol	21574577	Click to see CC1(CCC2(C(C1O)CCC3(C2CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C)C)C	460.70	unknown	via CMAUP database
(2R,5S)-2-methyl-5-(6-methylhept-5-en-2-yl)bicyclo[3.1.0]hexan-2-ol	6428435	Click to see CC(CCC=C(C)C)C12CCC(C1C2)(C)O	222.37	unknown	https://doi.org/10.1002/CBDV.201300390
(3E)-4,8,11,11-tetramethylbicyclo[7.2.0]undec-3-en-5-ol	5370247	Click to see CC1CCC(C(=CCC2C1CC2(C)C)C)O	222.37	unknown	https://doi.org/10.1002/CBDV.201300390
(3S,4aR,6aS,6aS,6bS,8aS,9R,12aS,14aS,14bR)-4,4,6a,6b,10,10,12a,14b-octamethyl-1,2,3,4a,5,6,6a,7,8,8a,9,11,12,13,14,14a-hexadecahydropicene-3,9-diol	21574567	Click to see CC1(CCC2(C(C1O)CCC3(C2CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C)C)C	444.70	unknown	via CMAUP database
(4aR,6aS,6aS,6bS,8aS,9R,12aS,14aS,14bR)-9-hydroxy-4,4,6a,6b,10,10,12a,14b-octamethyl-2,4a,5,6,6a,7,8,8a,9,11,12,13,14,14a-tetradecahydro-1H-picen-3-one	21574571	Click to see CC1(CCC2(C(C1O)CCC3(C2CCC4C3(CCC5C4(CCC(=O)C5(C)C)C)C)C)C)C	442.70	unknown	via CMAUP database
(4S)-1-methyl-4-[(2S,3E)-6-methylhepta-3,5-dien-2-yl]cyclohexene	163011619	Click to see CC1=CCC(CC1)C(C)C=CC=C(C)C	204.35	unknown	https://doi.org/10.1016/0031-9422(82)80129-5
(4S)-1-methyl-4-[(2S,3Z)-6-methylhepta-3,5-dien-2-yl]cyclohexene	163011618	Click to see CC1=CCC(CC1)C(C)C=CC=C(C)C	204.35	unknown	https://doi.org/10.1016/0031-9422(82)80129-5
(E)-2-epi-beta-caryophyllene	6429274	Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C	204.35	unknown	https://doi.org/10.1002/CBDV.201300390
(E)-beta-farnesene	10407	Click to see CC(=CCCC(=CCCC(=C)C=C)C)C	204.35	unknown	via CMAUP database
(E)-Muurola-4-(14),5-diene	6428453	Click to see CC1CCC(C2=CC(=C)CCC12)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/10.1021/JF60215A043 https://doi.org/10.1021/JF60160A012 https://doi.org/10.1271/NOGEIKAGAKU1924.63.185 https://doi.org/10.1002/(SICI)1099-1026(199909/10)14:5<268::AID-FFJ823>3.0.CO;2-Z
(Z)-2-methyl-6-(2-methyl-3-tricyclo[2.2.1.02,6]heptanyl)hept-2-en-1-ol	5352146	Click to see CC(CCC=C(C)CO)C1C2CC3C1(C3C2)C	234.38	unknown	via CMAUP database
(Z)-alpha-Bisabolene	5352653	Click to see CC1=CCC(CC1)C(=CCC=C(C)C)C	204.35	unknown	https://doi.org/10.1002/CBDV.201300390 https://doi.org/10.1021/JF980108M
(Z)-alpha-Santalol	5281531	Click to see CC(=CCCC1(C2CC3C1(C3C2)C)C)CO	220.35	unknown	via CMAUP database
(Z)-Bisabol-11-ol	91750291	Click to see CC1=CCC(CC1)C(=CCCC(C)(C)O)C	222.37	unknown	via CMAUP database
(Z)-caryophyllene	6429301	Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C	204.35	unknown	via CMAUP database
[(1S,3R,3aS,4S,8S,8aR)-1-acetyloxy-8-benzoyloxy-3-hydroxy-6,8a-dimethyl-3-propan-2-yl-1,2,3a,4,5,8-hexahydroazulen-4-yl] 4-methylbenzoate	163195153	Click to see CC1=CC(C2(C(CC(C2C(C1)OC(=O)C3=CC=C(C=C3)C)(C(C)C)O)OC(=O)C)C)OC(=O)C4=CC=CC=C4	534.60	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2005.05.010
[(2R,3R,4aR,6aS,6aS,6bS,8aS,12aS,14aS,14bR)-3-acetyloxy-4,4,6a,6b,10,10,12a,14b-octamethyl-9-oxo-2,3,4a,5,6,6a,7,8,8a,11,12,13,14,14a-tetradecahydro-1H-picen-2-yl] acetate	21574579	Click to see CC(=O)OC1CC2(C3CCC4C5(CCC(C(=O)C5CCC4(C3(CCC2C(C1OC(=O)C)(C)C)C)C)(C)C)C)C	542.80	unknown	via CMAUP database
[(2R,3R,4aR,6aS,6aS,6bS,8aS,9R,12aS,14aS,14bR)-2,9-dihydroxy-4,4,6a,6b,10,10,12a,14b-octamethyl-1,2,3,4a,5,6,6a,7,8,8a,9,11,12,13,14,14a-hexadecahydropicen-3-yl] acetate	21574576	Click to see CC(=O)OC1C(CC2(C3CCC4C5(CCC(C(C5CCC4(C3(CCC2C1(C)C)C)C)O)(C)C)C)C)O	502.80	unknown	via CMAUP database
[(2R,3R,4aR,6aS,6aS,6bS,8aS,9R,12aS,14aS,14bR)-3-acetyloxy-9-hydroxy-4,4,6a,6b,10,10,12a,14b-octamethyl-1,2,3,4a,5,6,6a,7,8,8a,9,11,12,13,14,14a-hexadecahydropicen-2-yl] acetate	21574574	Click to see CC(=O)OC1CC2(C3CCC4C5(CCC(C(C5CCC4(C3(CCC2C(C1OC(=O)C)(C)C)C)C)O)(C)C)C)C	544.80	unknown	via CMAUP database
[(3S,4aR,6aS,6aS,6bS,8aS,9R,12aS,14aS,14bR)-9-hydroxy-4,4,6a,6b,10,10,12a,14b-octamethyl-1,2,3,4a,5,6,6a,7,8,8a,9,11,12,13,14,14a-hexadecahydropicen-3-yl] acetate	101596674	Click to see CC(=O)OC1CCC2(C3CCC4C5(CCC(C(C5CCC4(C3(CCC2C1(C)C)C)C)O)(C)C)C)C	486.80	unknown	via CMAUP database
[1-Acetyloxy-3-hydroxy-6,8a-dimethyl-8-(3-phenylprop-2-enoyloxy)-3-propan-2-yl-1,2,3a,4,5,8-hexahydroazulen-4-yl] 2-methylbut-2-enoate	73046475	Click to see CC=C(C)C(=O)OC1CC(=CC(C2(C1C(CC2OC(=O)C)(C(C)C)O)C)OC(=O)C=CC3=CC=CC=C3)C	524.60	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2005.05.010
[3-Acetyloxy-1-hydroxy-3a,6-dimethyl-8-(2-methylbut-2-enoyloxy)-1-propan-2-yl-2,3,4,7,8,8a-hexahydroazulen-4-yl] benzoate	72992251	Click to see CC=C(C)C(=O)OC1CC(=CC(C2(C1C(CC2OC(=O)C)(C(C)C)O)C)OC(=O)C3=CC=CC=C3)C	498.60	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2005.05.010
1-Methyl-4-(1,5-dimethyl-2,4-hexadieneyl)cyclohexene	129659854	Click to see CC1=CCC(CC1)C(C)C=CC=C(C)C	204.35	unknown	https://doi.org/10.1016/0031-9422(82)80129-5
1-Methyl-4-(6-methylhepta-1,5-dien-2-yl)cyclohex-1-ene	403919	Click to see CC1=CCC(CC1)C(=C)CCC=C(C)C	204.35	unknown	via CMAUP database
1,2,4a,5,6,8a-Hexahydro-1-isopropyl-4,7-dimethylnaphthalene	101708	Click to see CC1=CC2C(CC1)C(=CCC2C(C)C)C	204.35	unknown	via CMAUP database
1,3,3-trimethyl-2-[(1E,3E,7E,15E,18E)-3,7,12,16-tetramethyl-18-(2,2,6-trimethylcyclohexylidene)octadeca-1,3,7,15-tetraen-5,9,13-triynyl]cyclohexene	51035411	Click to see CC1CCCC(C1=CCC(=CC#CC(C)CC#CC=C(C)C#CC=C(C)C=CC2=C(CCCC2(C)C)C)C)(C)C	534.90	unknown	via CMAUP database
1,4-Methanoazulene, decahydro-4,8,8-trimethyl-9-methylene-	17751022	Click to see CC1(CCCC2(C3C1C(C2=C)CC3)C)C	204.35	unknown	via CMAUP database
1,4-Methanoazulene, decahydro-4,8,8-trimethyl-9-methylene-, (1S,3aR,4S,8aS)-	16217634	Click to see CC1(CCCC2(C3C1C(C2=C)CC3)C)C	204.35	unknown	via CMAUP database
14-Hydroxy-9-epi-(E)-caryophyllene	5352484	Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)CO	220.35	unknown	https://doi.org/10.1002/CBDV.201300390
14-Hydroxy-9-epi-caryophyllene	12300118	Click to see CC1(CC2C1CCC(=CCCC2=C)CO)C	220.35	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-[(3r,5s,8r)-3,8-Dimethyl-1,2,3,4,5,6,7,8-octahydroazulen-5-yl]propan-2-ol	72607	Click to see CC1CCC(CC2=C1CCC2C)C(C)(C)O	222.37	unknown	via CMAUP database
2-[(3R,6S)-6,10-dimethylspiro[4.5]dec-9-en-3-yl]propan-2-ol	161437	Click to see CC1CCC=C(C12CCC(C2)C(C)(C)O)C	222.37	unknown	via CMAUP database
2-hydroxy-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]chromen-4-one	5459230	Click to see CC(=CCCC(=CCCC(=CCC1=C(OC2=CC=CC=C2C1=O)O)C)C)C	366.50	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2005.05.010
2alpha-Acetoxystictane-3beta,22alpha-diol	21574575	Click to see CC(=O)OC1CC2(C3CCC4C5(CCC(C(C5CCC4(C3(CCC2C(C1O)(C)C)C)C)O)(C)C)C)C	502.80	unknown	via CMAUP database
3-((1S)-1,5-Dimethyl-4-hexenyl)-6-methylene-1-cyclohexene, (3R)-	91746521	Click to see CC(CCC=C(C)C)C1CCC(=C)C=C1	204.35	unknown	via CMAUP database
3-(1,5-Dimethyl-4-hexenyl)-6-methylene-1-cyclohexene	519764	Click to see CC(CCC=C(C)C)C1CCC(=C)C=C1	204.35	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
3,7(11)-Eudesmadiene	522296	Click to see CC1=CCCC2(C1CC(=C(C)C)CC2)C	204.35	unknown	via CMAUP database
3a(1H)-Azulenol, 2,3,4,5,8,8a-hexahydro-6,8a-dimethyl-3-(1-methylethyl)-, [3R-(3alpha,3aalpha,8aalpha)]-	6432448	Click to see CC1=CCC2(CCC(C2(CC1)O)C(C)C)C	222.37	unknown	via CMAUP database
3aalpha(1H)-Azulenol, 2,3,4,5,8,8a-hexahydro-3alpha-isopropyl-6,8aalpha-dimethyl-, (+)-	287687	Click to see CC1=CCC2(CCC(C2(CC1)O)C(C)C)C	222.37	unknown	via CMAUP database
4-Isopropyl-1,6-dimethyl-1,2,3,4,4a,7,8,8a-octahydro-1-naphthalenol	519662	Click to see CC1=CC2C(CCC(C2CC1)(C)O)C(C)C	222.37	unknown	via CMAUP database
4,11,11-Trimethyl-8-methylene-5-oxatricyclo(8.2.0.0(4,6))dodecane, (1R,4R,6R,10S)-	6604672	Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C	220.35	unknown	via CMAUP database
4,7-Dimethyl-7-(4-methylpent-3-enyl)bicyclo[2.2.1]heptan-3-ol	5315645	Click to see CC(=CCCC1(C2CCC1(C(C2)O)C)C)C	222.37	unknown	via CMAUP database
6,10,10-Trimethyl-2-methylidenebicyclo[7.2.0]undecane	18372029	Click to see CC1CCCC(=C)C2CC(C2CC1)(C)C	206.37	unknown	https://doi.org/10.1016/0031-9422(82)80084-8
7-epi-Sesquithujene	56927990	Click to see CC1=CCC2(C1C2)C(C)CCC=C(C)C	204.35	unknown	via CMAUP database
7,11-Dimethyl-3-methylene-1,6Z,10-dodecatriene	56936085	Click to see CCC(=C)CCC=C(C)CCC=C(C)C	206.37	unknown	https://doi.org/10.1002/CBDV.201300390
Agarospirol	21675005	Click to see CC1CCC=C(C12CCC(C2)C(C)(C)O)C	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
alpha-Cadinol #1	6431302	Click to see CC1=CC2C(CCC(C2CC1)(C)O)C(C)C	222.37	unknown	via CMAUP database
alpha-IONONE	5282108	Click to see CC1=CCCC(C1C=CC(=O)C)(C)C	192.30	unknown	https://doi.org/10.1021/JF60198A031
alpha-Patchoulene	521710	Click to see CC1CCC23C1CC(C2(C)C)CC=C3C	204.35	unknown	via CMAUP database
alpha-Santalene	94164	Click to see CC(=CCCC1(C2CC3C1(C3C2)C)C)C	204.35	unknown	https://doi.org/10.1002/CBDV.201300390
beta Farnesene	15228937	Click to see CCC(=C)CCC=C(C)CCC=C(C)C	206.37	unknown	https://doi.org/10.1021/JF60215A043
Beta-Bisabolene	10104370	Click to see CC1=CCC(CC1)C(=C)CCC=C(C)C	204.35	unknown	https://doi.org/10.1021/JF60215A043 https://doi.org/10.1021/JF60160A012 https://doi.org/10.1271/NOGEIKAGAKU1924.63.185 https://doi.org/10.1002/(SICI)1099-1026(199909/10)14:5<268::AID-FFJ823>3.0.CO;2-Z
beta-Bourbonene	62566	Click to see CC(C)C1CCC2(C1C3C2CCC3=C)C	204.35	unknown	https://doi.org/10.1016/0031-6865(94)00054-Y
beta-CARYOPHYLLENE OXIDE	1742210	Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C	220.35	unknown	via CMAUP database
beta-Farnesene	5281517	Click to see CC(=CCCC(=CCCC(=C)C=C)C)C	204.35	unknown	https://doi.org/10.1002/(SICI)1099-1026(199909/10)14:5<268::AID-FFJ823>3.0.CO;2-Z
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/10.1021/JF60221A041 https://doi.org/10.1021/JF60198A031
beta-Oplopenone	21626411	Click to see CC(C)C1CCC(=C)C2C1C(CC2)C(=O)C	220.35	unknown	via CMAUP database
Bicyclo[7.2.0]undec-4-ene, 4,11,11-trimethyl-8-methylene-, (1S,4E,9R)-	26318	Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C	204.35	unknown	https://doi.org/10.1016/0031-9422(82)80129-5
Bisabolene	62346	Click to see CC1=CCC(=C(C)CCC=C(C)C)CC1	204.35	unknown	https://doi.org/10.1248/YAKUSHI1881.1926.538_1003
Bisabolol	1549992	Click to see CC1=CCC(CC1)C(C)(CCC=C(C)C)O	222.37	unknown	via CMAUP database
Bulnesol	90785	Click to see CC1CCC2=C(CCC(CC12)C(C)(C)O)C	222.37	unknown	via CMAUP database
Carotol	442347	Click to see CC1=CCC2(CCC(C2(CC1)O)C(C)C)C	222.37	unknown	https://doi.org/10.1021/JF60160A012 https://doi.org/10.1002/FFJ.2730040414 https://doi.org/10.1002/(SICI)1099-1026(199909/10)14:5<268::AID-FFJ823>3.0.CO;2-Z https://doi.org/10.1021/JF60198A031
Caryophylla-4(14), 8(15)-dien-5-ol	6428430	Click to see CC1(CC2C1CCC(=C)C(CCC2=C)O)C	220.35	unknown	via CMAUP database
Caryophyllene	5281515	Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C	204.35	unknown	https://doi.org/10.1016/S0031-9422(00)81741-0 https://doi.org/10.1016/0031-9422(82)80129-5 https://doi.org/10.1016/0308-8146(92)90304-K https://doi.org/10.1021/JF60160A012 https://doi.org/10.1021/JF60198A031 https://doi.org/10.1021/JF980108M https://doi.org/10.1021/JF60215A043
Caryophyllene epoxide	14350	Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C	220.35	unknown	via CMAUP database
Caryophyllene oxide 2	13240188	Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C	220.35	unknown	via CMAUP database
Caryophyllene,alpha + beta mixt.	5354499	Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C	204.35	unknown	https://doi.org/10.1021/JF60215A043 https://doi.org/10.1021/JF60160A012 https://doi.org/10.1016/0308-8146(92)90304-K
Caryophyllenyl alcohol	91704770	Click to see CC1CCC(C(=CCC2C1CC2(C)C)C)O	222.37	unknown	via CMAUP database
CID 16212927	16212927	Click to see CC(C)C1CCC2(C3C1C4C2(C4C3)C)C	204.35	unknown	via CMAUP database
cis-Muurola-4(14),5-diene	51351709	Click to see CC1CCC(C2=CC(=C)CCC12)C(C)C	204.35	unknown	via CMAUP database
Copaene	19725	Click to see CC1=CCC2C3C1C2(CCC3C(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
Cyclohexene, 4-ethenyl-4-methyl-3-(1-methylethenyl)-1-(1-methylethyl)-, (3R-trans)-	89316	Click to see CC(C)C1=CC(C(CC1)(C)C=C)C(=C)C	204.35	unknown	https://doi.org/10.1021/JF980108M
Cyclosativene	519960	Click to see CC(C)C1CCC2(C3C1C4C2(C4C3)C)C	204.35	unknown	via CMAUP database
d-alpha-Santalol	5368797	Click to see CC(=CCCC1(C2CC3C1(C3C2)C)C)CO	220.35	unknown	https://doi.org/10.1002/CBDV.201300390
Daucene	177773	Click to see CC1=CCC2(CCC(=C2CC1)C(C)C)C	204.35	unknown	https://doi.org/10.1002/CBDV.201300390
delta-Amorphene	12306056	Click to see CC1=CC2C(CCC(=C2CC1)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
delta-Elemene	12309449	Click to see CC(C)C1=CC(C(CC1)(C)C=C)C(=C)C	204.35	unknown	https://doi.org/10.1021/JF980108M
Dimethylionone	6441344	Click to see CCC(=O)C(=CC1C(=CCCC1(C)C)C)C	220.35	unknown	via CMAUP database
epi-Cubenol	519857	Click to see CC1CCC(C2C1(CCC(=C2)C)O)C(C)C	222.37	unknown	https://doi.org/10.1002/CBDV.201300390
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/JF60198A031 https://doi.org/10.1021/JF60160A012 https://doi.org/10.1016/0308-8146(92)90304-K https://doi.org/10.1021/JF60215A043 https://doi.org/10.1248/YAKUSHI1881.1926.538_1003
gamma-Muurolene	12313020	Click to see CC1=CC2C(CC1)C(=C)CCC2C(C)C	204.35	unknown	https://doi.org/10.1021/JF60215A043
Guaiol	227829	Click to see CC1CCC(CC2=C1CCC2C)C(C)(C)O	222.37	unknown	via CMAUP database
Hinesol	289964	Click to see CC1CCC=C(C12CCC(C2)C(C)(C)O)C	222.37	unknown	via CMAUP database
Humulene	5281520	Click to see CC1=CCC(C=CCC(=CCC1)C)(C)C	204.35	unknown	https://doi.org/10.1021/JF60215A043
Isocaryophyllene oxide	1742211	Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C	220.35	unknown	via CMAUP database
Isolongifolene	11127402	Click to see CC1(CCC=C2C13CCC(C3)C2(C)C)C	204.35	unknown	via CMAUP database
Junipene	5489258	Click to see CC1(CCCC2(C3C1C(C2=C)CC3)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
Longifolene	289151	Click to see CC1(CCCC2(C3C1C(C2=C)CC3)C)C	204.35	unknown	via CMAUP database
Naphthalene, 1,2,3,4,4a,5,6,8a-octahydro-4a,8-dimethyl-2-(1-methylethylidene)-, (4aR-trans)-	6432648	Click to see CC1=CCCC2(C1CC(=C(C)C)CC2)C	204.35	unknown	via CMAUP database
Naphthalene, 1,2,3,5,6,8a-hexahydro-4,7-dimethyl-1-(1-methylethyl)-, (1S-cis)-	12306059	Click to see CC1=CC2C(CCC(=C2CC1)C)C(C)C	204.35	unknown	via CMAUP database
Oplopenone	6429350	Click to see CC(C)C1CCC(=C)C2C1C(CC2)C(=O)C	220.35	unknown	via CMAUP database
Selina-4(15),7(11)-diene	10655819	Click to see CC(=C1CCC2(CCCC(=C)C2C1)C)C	204.35	unknown	via CMAUP database
Sesquisabinene hydrate	20055539	Click to see CC(CCC=C(C)C)C12CCC(C1C2)(C)O	222.37	unknown	via CMAUP database
tau-Cadinol	12302222	Click to see CC1=CC2C(CCC(C2CC1)(C)O)C(C)C	222.37	unknown	via CMAUP database
tau-Muurolol	6432221	Click to see CC1=CC2C(CCC(C2CC1)(C)O)C(C)C	222.37	unknown	via CMAUP database
trans-Cadina-1(6),4-diene	10798255	Click to see CC1CCC(C2=C1CCC(=C2)C)C(C)C	204.35	unknown	via CMAUP database
trans-Nerolidol	5284507	Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C	222.37	unknown	via CMAUP database
trans-Sesquisabinene hydrate	6428444	Click to see CC(CCC=C(C)C)C12CCC(C1C2)(C)O	222.37	unknown	https://doi.org/10.1002/CBDV.201300390
Velvetone	5372151	Click to see CCC(=O)C(=CC1=C(CCCC1(C)C)C)C	220.35	unknown	https://doi.org/10.1002/CBDV.201300390
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Aristolane sesquiterpenoids
(+)-Aristolone	12305213	Click to see CC1CCCC2=CC(=O)C3C(C12C)C3(C)C	218.33	unknown	via CMAUP database
Aristol-9-en-3-ol	91747184	Click to see CC1C(CCC2=CCC3C(C12C)C3(C)C)O	220.35	unknown	https://doi.org/10.1016/0031-6865(94)00054-Y
Aristolone	165536	Click to see CC1CCCC2=CC(=O)C3C(C12C)C3(C)C	218.33	unknown	https://doi.org/10.1002/CBDV.201300390
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Aromadendrane sesquiterpenoids / 5,10-cycloaromadendrane sesquiterpenoids
(+)-Aromadendrene	11095734	Click to see CC1CCC2C1C3C(C3(C)C)CCC2=C	204.35	unknown	via CMAUP database
(1aS,4aS,7aS,7bR)-1,1,7-trimethyl-4-methylidene-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene	91746456	Click to see CC1CCC2C1C3C(C3(C)C)CCC2=C	204.35	unknown	via CMAUP database
(1aS,4aS,7R,7aS,7bS)-1,1,7-Trimethyl-4-methylenedecahydro-1H-cyclopropa[e]azulen-7-ol	6432706	Click to see CC1(C2C1C3C(CCC3(C)O)C(=C)CC2)C	220.35	unknown	via CMAUP database
1H-Cycloprop[e]azulen-7-ol, decahydro-1,1,7-trimethyl-4-methylene-, [1ar-(1aalpha,4aalpha,7beta,7abeta,7balpha)]-	6432640	Click to see CC1(C2C1C3C(CCC3(C)O)C(=C)CC2)C	220.35	unknown	via CMAUP database
1H-Cycloprop[e]azulene, 1a,2,3,4,4a,5,6,7b-octahydro-1,1,4,7-tetramethyl-, (1aR,4R,4aR,7bS)-	521243	Click to see CC1CCC2C(C2(C)C)C3=C(CCC13)C	204.35	unknown	via CMAUP database
Aromadendrene	91354	Click to see CC1CCC2C1C3C(C3(C)C)CCC2=C	204.35	unknown	via CMAUP database
beta-Diploalbicene	177445	Click to see CC1CCC2C1C3C(C3(C)C)CCC2=C	204.35	unknown	via CMAUP database
beta-Spathulenol	522266	Click to see CC1(C2C1C3C(CCC3(C)O)C(=C)CC2)C	220.35	unknown	via CMAUP database
Ent-Spathulenol	13854255	Click to see CC1(C2C1C3C(CCC3(C)O)C(=C)CC2)C	220.35	unknown	via CMAUP database
Spathulenol	92231	Click to see CC1(C2C1C3C(CCC3(C)O)C(=C)CC2)C	220.35	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Bicyclogermacrane and isolepidozane sesquiterpenoids
(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	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
Bicyclogermacrene	13894537	Click to see CC1=CCCC(=CC2C(C2(C)C)CC1)C	204.35	unknown	via CMAUP database
trans-Bicyclogermacradiene	11820258	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 / Cedrane and isocedrane sesquiterpenoids
Cedrol	65575	Click to see CC1CCC2C13CCC(C(C3)C2(C)C)(C)O	222.37	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Chamigranes
Junicedranol	91753598	Click to see CC1(CCCC2(C13CCC2(C(C3)O)C)C)C	222.37	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Elemane sesquiterpenoids
(2R,3S)-3-ethenyl-3-methyl-6-propan-2-yl-2-prop-1-en-2-ylcyclohexan-1-one	129316923	Click to see CC(C)C1CCC(C(C1=O)C(=C)C)(C)C=C	220.35	unknown	https://doi.org/10.1016/0031-6865(94)00054-Y
[1R-[1alpha,3alpha,4beta]]-4-Ethenyl-alpha,alpha,4-trimethyl-3-[1-methylethenyl]cyclohexanemethanol	11064030	Click to see CC(=C)C1CC(CCC1(C)C=C)C(C)(C)O	222.37	unknown	via CMAUP database
2-(4-Ethenyl-4-methyl-3-prop-1-en-2-ylcyclohexyl)propan-2-ol	547972	Click to see CC(=C)C1CC(CCC1(C)C=C)C(C)(C)O	222.37	unknown	https://doi.org/10.1002/CBDV.201300390
2-[(1R,3S,4S)-4-ethenyl-4-methyl-3-prop-1-en-2-ylcyclohexyl]propan-2-yl acetate	12978153	Click to see CC(=C)C1CC(CCC1(C)C=C)C(C)(C)OC(=O)C	264.40	unknown	via CMAUP database
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
Elemol	92138	Click to see CC(=C)C1CC(CCC1(C)C=C)C(C)(C)O	222.37	unknown	via CMAUP database
Shyobunone	5321293	Click to see CC(C)C1CCC(C(C1=O)C(=C)C)(C)C=C	220.35	unknown	https://doi.org/10.1016/0031-6865(94)00054-Y
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eudesmane, isoeudesmane or cycloeudesmane sesquiterpenoids
2-(4a-Methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)propan-2-ol	521215	Click to see CC12CCCC(=C)C1CC(CC2)C(C)(C)O	222.37	unknown	via CMAUP database
2-Naphthalenemethanol, decahydro-alpha,alpha,4a-trimethyl-8-methylene-, [2R-(2alpha,4aalpha,8abeta)]-	6432456	Click to see CC12CCCC(=C)C1CC(CC2)C(C)(C)O	222.37	unknown	via CMAUP database
7-Isopropenyl-4a-methyl-1-methylenedecahydronaphthalene	519361	Click to see CC(=C)C1CCC2(CCCC(=C)C2C1)C	204.35	unknown	via CMAUP database
beta-EUDESMOL	91457	Click to see CC12CCCC(=C)C1CC(CC2)C(C)(C)O	222.37	unknown	via CMAUP database
beta-Selinene	442393	Click to see CC(=C)C1CCC2(CCCC(=C)C2C1)C	204.35	unknown	via CMAUP database
Naphthalene, 1,2,3,4,4a,5,6,8a-octahydro-4a,8-dimethyl-2-(1-methylethenyl)-, [2R-(2alpha,4aalpha,8abeta)]-	6432455	Click to see CC1=CCCC2(C1CC(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,6Z)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene	5373727	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
(S,1Z,6Z)-8-Isopropyl-1-methyl-5-methylenecyclodeca-1,6-diene	91723653	Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C	204.35	unknown	https://doi.org/10.1021/JF980108M
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
Germacrene B	5281519	Click to see CC1=CCCC(=CCC(=C(C)C)CC1)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	https://doi.org/10.1021/JF980108M
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Guaianes
(5S,6R,8S,8aS)-6,8a-dihydroxy-5-(2-hydroxypropan-2-yl)-3,8-dimethyl-1,4,5,6,7,8-hexahydroazulen-2-one	45102166	Click to see CC1CC(C(CC2=C(C(=O)CC12O)C)C(C)(C)O)O	268.35	unknown	https://doi.org/10.1002/HLCA.200900106
2-(6-hydroxy-3,8-dimethyl-2-oxo-4,5,6,7,8,8a-hexahydro-1H-azulen-5-yl)propan-2-yl acetate	75090583	Click to see CC1CC(C(CC2=C(C(=O)CC12)C)C(C)(C)OC(=O)C)O	294.40	unknown	https://doi.org/10.1002/HLCA.200900106
2-[(5S,6R,8S,8aR)-6-hydroxy-3,8-dimethyl-2-oxo-4,5,6,7,8,8a-hexahydro-1H-azulen-5-yl]propan-2-yl acetate	45102165	Click to see CC1CC(C(CC2=C(C(=O)CC12)C)C(C)(C)OC(=O)C)O	294.40	unknown	https://doi.org/10.1002/HLCA.200900106
6,8a-Dihydroxy-5-(2-hydroxypropan-2-yl)-3,8-dimethyl-1,4,5,6,7,8-hexahydroazulen-2-one	75090584	Click to see CC1CC(C(CC2=C(C(=O)CC12O)C)C(C)(C)O)O	268.35	unknown	https://doi.org/10.1002/HLCA.200900106
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Himachalane and lippifoliane sesquiterpenoids
(1R,6S)-gamma-himachalene	6428535	Click to see CC1=CC2C(CC1)C(=CCCC2(C)C)C	204.35	unknown	via CMAUP database
beta-Himachalene	11586487	Click to see CC1=CC2C(=C(CCCC2(C)C)C)CC1	204.35	unknown	via CMAUP database
gamma-HIMACHALENE	577062	Click to see CC1=CC2C(CC1)C(=CCCC2(C)C)C	204.35	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Triquinane sesquiterpenoids / Angular triquinanes
Silphiperfol-5-en-3-ol A	91747331	Click to see CC1CCC23C1CC(C2(C=C(C3C)C)C)O	220.35	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones
2-Hydroxy-3-(3,7,11-trimethyldodeca-2,6,10-trien-1-yl)chromen-4-one	54683686	Click to see CC(=CCCC(=CCCC(=CCC1=C(C2=CC=CC=C2OC1=O)O)C)C)C	366.50	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2005.05.010
7-{[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]oxy}-2H-chromen-2-one	5287282	Click to see CC(=CCCC(=CCCC(=CCOC1=CC2=C(C=C1)C=CC(=O)O2)C)C)C	366.50	unknown	via CMAUP database
Ferulenol	54679300	Click to see CC(=CCCC(=CCCC(=CCC1=C(C2=CC=CC=C2OC1=O)O)C)C)C	366.50	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2005.05.010
> Lipids and lipid-like molecules / Prenol lipids / Tetraterpenoids / Carotenoids / Carotenes
2,8,10,12,14,16,18,20,22,24,26,30-Dotriacontatridecaene, 2,6,10,14,19,23,27,31-octamethyl-, (all-E)-	54603520	Click to see CC(=CCCC(=CC=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC=C(C)CCC=C(C)C)C)C)C)C	536.90	unknown	via CMAUP database
6-[(1E,3Z,5E,7Z,9E,11E,13E,15E,17E,19E)-3,7,12,16,20,24-hexamethylpentacosa-1,3,5,7,9,11,13,15,17,19,23-undecaenyl]-1,5,5-trimethylcyclohexene	9807220	Click to see CC1=CCCC(C1C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC=C(C)CCC=C(C)C)C)C)(C)C	536.90	unknown	via CMAUP database
9-cis-beta-Carotene	9828626	Click to see CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC2=C(CCCC2(C)C)C)C)C	536.90	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1054666/
all-trans-alpha-Carotene	4369188	Click to see CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC2C(=CCCC2(C)C)C)C)C	536.90	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1054666/ https://doi.org/10.1111/J.1365-2621.1996.TB12198.X https://doi.org/10.1021/AC961911N https://doi.org/10.1021/JF00059A019
alpha-Carotene	6419725	Click to see CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC2C(=CCCC2(C)C)C)C)C	536.90	unknown	https://doi.org/10.1021/JF9708655 https://doi.org/10.1021/JF00059A019 https://doi.org/10.1111/J.1365-2621.1996.TB12198.X
Beta-Carotene	5280489	Click to see CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC2=C(CCCC2(C)C)C)C)C	536.90	unknown	https://doi.org/10.1021/JF00059A019 https://doi.org/10.1111/J.1365-2621.1986.TB10851.X https://doi.org/10.1111/J.1365-2621.1996.TB12198.X https://doi.org/10.1021/AC961911N
epsilon,psi-Carotene, (6R)-	5281230	Click to see CC1=CCCC(C1C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC=C(C)CCC=C(C)C)C)C)(C)C	536.90	unknown	via CMAUP database
gamma-Carotene	5280791	Click to see CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC=C(C)CCC=C(C)C)C)C	536.90	unknown	via CMAUP database
zeta-Carotene	5280788	Click to see CC(=CCCC(=CCCC(=CC=CC(=CC=CC=C(C)C=CC=C(C)CCC=C(C)CCC=C(C)C)C)C)C)C	540.90	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
(6aR,6bR,8aR,14bR)-4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,12,12a,13,14,14a-hexadecahydropicen-3-ol	145706026	Click to see CC1C2C3CCC4C5(CCC(C(C5CCC4(C3(CCC2(CCC1=C)C)C)C)(C)C)O)C	426.70	unknown	https://doi.org/10.1016/0378-8741(84)90002-3
Beta-Amyrin	73145	Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C)C	426.70	unknown	https://doi.org/10.1016/0378-8741(84)90002-3
Pfaffic acid	441936	Click to see CC1(C2CCC3(C(C2(CCC1O)C)CC=C4C3(CC5C6(CCC5(C4C6)C(=O)O)C)C)C)C	440.70	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Bile acids, alcohols and derivatives / Hydroxy bile acids, alcohols and derivatives / Tetrahydroxy bile acids, alcohols and derivatives
(2R,3S,5S,8R,9R,10R,13S,14S,17R)-17-[(2S,3R,4R,5R)-3,4-dihydroxy-5,6-dimethylheptan-2-yl]-2,3-dihydroxy-10,13-dimethyl-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one	636484	Click to see CC(C)C(C)C(C(C(C)C1CCC2C1(CCC3C2CC(=O)C4C3(CC(C(C4)O)O)C)C)O)O	464.70	unknown	https://doi.org/10.1002/(SICI)1099-1565(199801/02)9:1<14::AID-PCA381>3.0.CO;2-4
24-Epicastasterone	11812633	Click to see CC(C)C(C)C(C(C(C)C1CCC2C1(CCC3C2CC(=O)C4C3(CC(C(C4)O)O)C)C)O)O	464.70	unknown	https://doi.org/10.1002/(SICI)1099-1565(199801/02)9:1<14::AID-PCA381>3.0.CO;2-4
Castasterone	133534	Click to see CC(C)C(C)C(C(C(C)C1CCC2C1(CCC3C2CC(=O)C4C3(CC(C(C4)O)O)C)C)O)O	464.70	unknown	https://doi.org/10.1002/(SICI)1099-1565(199801/02)9:1<14::AID-PCA381>3.0.CO;2-4
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Oxosteroids / 16-oxosteroids
[(2R,3R,4aR,6aS,6aS,6bS,8aS,9R,12aS,14aS,14bR)-3,9-diacetyloxy-4,4,6a,6b,10,10,12a,14b-octamethyl-1,2,3,4a,5,6,6a,7,8,8a,9,11,12,13,14,14a-hexadecahydropicen-2-yl] acetate	21574583	Click to see CC(=O)OC1CC2(C3CCC4C5(CCC(C(C5CCC4(C3(CCC2C(C1OC(=O)C)(C)C)C)C)OC(=O)C)(C)C)C)C	586.80	unknown	via CMAUP database
[(3S,4aR,6aS,6aS,6bS,8aS,9R,12aS,14aS,14bR)-9-acetyloxy-4,4,6a,6b,10,10,12a,14b-octamethyl-1,2,3,4a,5,6,6a,7,8,8a,9,11,12,13,14,14a-hexadecahydropicen-3-yl] acetate	21574568	Click to see CC(=O)OC1CCC2(C3CCC4C5(CCC(C(C5CCC4(C3(CCC2C1(C)C)C)C)OC(=O)C)(C)C)C)C	528.80	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Pregnane steroids / Gluco/mineralocorticoids, progestogins and derivatives
[(3R,5S,8S,9S,10S,11R,13R,14S,17R)-17-ethenyl-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-11-yl] acetate	25180961	Click to see CC(=O)OC1CC2(C(CCC2C3C1C4(CCC(CC4CC3)O)C)C=C)C	360.50	unknown	https://doi.org/10.1021/NP50022A003
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroid lactones / Brassinolides and derivatives
Brassinolide	115196	Click to see CC(C)C(C)C(C(C(C)C1CCC2C1(CCC3C2COC(=O)C4C3(CC(C(C4)O)O)C)C)O)O	480.70	unknown	https://doi.org/10.1002/(SICI)1099-1565(199801/02)9:1<14::AID-PCA381>3.0.CO;2-4
> 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
(3R,8R,9R,10S,13R,14R,17S)-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-ol	162965363	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	414.70	unknown	https://doi.org/10.1016/S0031-9422(00)91505-X
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/10.1007/BF00575189 https://doi.org/10.1016/S0031-9422(00)91505-X https://doi.org/10.1007/BF01012274
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/10.1007/BF01012274
Clionasterol	457801	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	414.70	unknown	https://doi.org/10.1007/BF00575189
Sitogluside	5742590	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C	576.80	unknown	https://doi.org/10.1055/S-2008-1074990
> Nucleosides, nucleotides, and analogues / Purine nucleosides
Vidarabine	21704	Click to see C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)CO)O)O)N	267.24	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Alanine and derivatives
(2S)-2-(phenylazaniumyl)propanoate	6946449	Click to see CC(C(=O)[O-])[NH2+]C1=CC=CC=C1	165.19	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
Alanine	5950	Click to see CC(C(=O)O)N	89.09	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
D-alanine	71080	Click to see CC(C(=O)O)N	89.09	unknown	https://doi.org/10.1079/9781780642635.0298 https://doi.org/10.1016/0008-6215(84)85339-2
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Alpha amino acids / L-alpha-amino acids
Arginine	6322	Click to see C(CC(C(=O)O)N)CN=C(N)N	174.20	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
Lysine	5962	Click to see C(CCN)CC(C(=O)O)N	146.19	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
Threonine	6288	Click to see CC(C(C(=O)O)N)O	119.12	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Aspartic acid and derivatives
Aspartic Acid	5960	Click to see C(C(C(=O)O)N)C(=O)O	133.10	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
D-Aspartic acid	83887	Click to see C(C(C(=O)O)N)C(=O)O	133.10	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Glutamic acid and derivatives
Glutamic Acid	33032	Click to see C(CC(=O)O)C(C(=O)O)N	147.13	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Histidine and derivatives
Histidine	6274	Click to see C1=C(NC=N1)CC(C(=O)O)N	155.15	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Isoleucine and derivatives
l-Isoleucine	6306	Click to see CCC(C)C(C(=O)O)N	131.17	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Leucine and derivatives
Leucine	6106	Click to see CC(C)CC(C(=O)O)N	131.17	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Phenylalanine and derivatives
D-phenylalanine	71567	Click to see C1=CC=C(C=C1)CC(C(=O)O)N	165.19	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Proline and derivatives
4-Hydroxy-L-proline	69248	Click to see C1C(CNC1C(=O)O)O	131.13	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
cis-4-Hydroxy-L-proline	440015	Click to see C1C(CNC1C(=O)O)O	131.13	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
Proline	145742	Click to see C1CC(NC1)C(=O)O	115.13	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Serine and derivatives
Serine	5951	Click to see C(C(C(=O)O)N)O	105.09	unknown	https://doi.org/10.1079/9781780642635.0298 https://doi.org/10.1016/0008-6215(84)85339-2
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Tyrosine and derivatives
Tyrosine	6057	Click to see C1=CC(=CC=C1CC(C(=O)O)N)O	181.19	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Valine and derivatives
Valine	6287	Click to see CC(C)C(C(=O)O)N	117.15	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
> Organic acids and derivatives / Carboxylic acids and derivatives / Carboxylic acid derivatives / Carboxylic acid esters
cis-3-Hexenyl acetate	5363388	Click to see CCC=CCCOC(=O)C	142.20	unknown	via CMAUP database
Hex-3-enyl acetate	15574	Click to see CCC=CCCOC(=O)C	142.20	unknown	via CMAUP database
trans-3-Hexenyl acetate	5352557	Click to see CCC=CCCOC(=O)C	142.20	unknown	https://doi.org/10.1002/CBDV.201300390
> Organic acids and derivatives / Hydroxy acids and derivatives / Beta hydroxy acids and derivatives
Daucic acid	5316316	Click to see C1=C(OC(C(C1O)O)C(=O)O)C(=O)O	204.13	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclic alcohols and derivatives
(1R,2R,5R,7R,8S)-2,6,6,8-tetramethyltricyclo[6.2.1.01,5]undecan-7-ol	101985389	Click to see CC1CCC2C13CCC(C3)(C(C2(C)C)O)C	222.37	unknown	via CMAUP database
Sesquithuriferol	91750097	Click to see CC1CCC2C13CCC(C3)(C(C2(C)C)O)C	222.37	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Quinic acids and derivatives
3-{[(2Z)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,4,5-trihydroxycyclohexane-1-carboxylic acid	25210304	Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O	354.31	unknown	https://doi.org/10.1016/0031-9422(88)80745-3
Chlorogenic Acid	1794427	Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O	354.31	unknown	https://doi.org/10.1016/0003-9861(87)90339-0 https://doi.org/10.1024/0300-9831.73.2.152 https://doi.org/10.3136/FSTR.7.307 https://doi.org/10.1111/J.1744-7348.1988.TB02036.X
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Shikimic acids and derivatves
3,4,5-Trihydroxy-1-cyclohexene-1-carboxylic acid	1094	Click to see C1C(C(C(C=C1C(=O)O)O)O)O	174.15	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1066914/
Shikimic acid	8742	Click to see C1C(C(C(C=C1C(=O)O)O)O)O	174.15	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1066914/
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Secondary alcohols
(4S)-3,3,6-trimethylhepta-1,5-dien-4-ol	12308602	Click to see CC(=CC(C(C)(C)C=C)O)C	154.25	unknown	via CMAUP database
3,3,6-Trimethylhepta-1,5-dien-4-ol	100197	Click to see CC(=CC(C(C)(C)C=C)O)C	154.25	unknown	https://doi.org/10.1002/CBDV.201300390
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Tertiary alcohols
(1S,3S,4aS,5S,8aS)-5-(hydroxymethyl)-3-(2-hydroxypropan-2-yl)-1-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-naphthalen-1-ol	162938996	Click to see CC1(CC(CC2C1CCCC2CO)C(C)(C)O)O	256.38	unknown	https://doi.org/10.3390/MOLECULES14103868
(E)-2,5,5-Trimethylhepta-3,6-dien-2-ol	5315406	Click to see CC(C)(C=C)C=CC(C)(C)O	154.25	unknown	https://doi.org/10.1002/CBDV.201300390
5-(hydroxymethyl)-3-(2-hydroxypropan-2-yl)-1-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-naphthalen-1-ol	162938995	Click to see CC1(CC(CC2C1CCCC2CO)C(C)(C)O)O	256.38	unknown	https://doi.org/10.3390/MOLECULES14103868
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds
(2R,3R,4S,5S,6R)-2-[[(1R,2R,3R,5R,6R,8S,12S)-8,12-dihydroxy-1,5,9,9-tetramethyl-10-oxatricyclo[6.2.2.02,6]dodecan-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol	163079455	Click to see CC1CC(C2C1CC3(C(CC2(OC3(C)C)C)O)O)OC4C(C(C(C(O4)CO)O)O)O	432.50	unknown	https://doi.org/10.1016/J.FITOTE.2009.12.008
2-[(8,12-Dihydroxy-1,5,9,9-tetramethyl-10-oxatricyclo[6.2.2.02,6]dodecan-3-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol	85284151	Click to see CC1CC(C2C1CC3(C(CC2(OC3(C)C)C)O)O)OC4C(C(C(C(O4)CO)O)O)O	432.50	unknown	https://doi.org/10.1016/J.FITOTE.2009.12.008
Benzyl beta-d-glucopyranoside	188977	Click to see C1=CC=C(C=C1)COC2C(C(C(C(O2)CO)O)O)O	270.28	unknown	https://doi.org/10.3136/FSTR.7.307
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Monosaccharides / Hexoses
(2R,3R,4S,5S)-2,3,4,5-tetrahydroxyhexanal	19233	Click to see CC(C(C(C(C=O)O)O)O)O	164.16	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
(2R,3S,4S,5R)-2,3,4,5,6-pentahydroxyhexanal	3037556	Click to see C(C(C(C(C(C=O)O)O)O)O)O	180.16	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
(2S,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanal	161658	Click to see C(C(C(C(C(C=O)O)O)O)O)O	180.16	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
D-Galactose	6036	Click to see C(C1C(C(C(C(O1)O)O)O)O)O	180.16	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
D-Glucose	5793	Click to see C(C1C(C(C(C(O1)O)O)O)O)O	180.16	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
D-Mannose	18950	Click to see C(C1C(C(C(C(O1)O)O)O)O)O	180.16	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
D(+)-Glucose	107526	Click to see C(C(C(C(C(C=O)O)O)O)O)O	180.16	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
L-Rhamnose	25310	Click to see CC1C(C(C(C(O1)O)O)O)O	164.16	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Monosaccharides / Pentoses
D-Xylose	135191	Click to see C1C(C(C(C(O1)O)O)O)O	150.13	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
DL-Xylose	644160	Click to see C(C(C(C(C=O)O)O)O)O	150.13	unknown	https://doi.org/10.1016/0008-6215(84)85339-2
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Oligosaccharides
Glycoprotein	439212	Click to see CC(=O)NC1C(C(C(OC1NC(=O)CC(C(=O)N)NC(=O)C)CO)OC2C(C(C(C(O2)CO)OC3C(C(C(C(O3)CO)O)O)O)O)NC(=O)C)O	741.70	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Sugar alcohols
Hexitol	453	Click to see C(C(C(C(C(CO)O)O)O)O)O	182.17	unknown	https://doi.org/10.1007/S10600-010-9479-7
L-Iditol	5460044	Click to see C(C(C(C(C(CO)O)O)O)O)O	182.17	unknown	https://doi.org/10.1007/S10600-010-9479-7
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Medium-chain aldehydes
(Z)-non-2-enal	5354833	Click to see CCCCCCC=CC=O	140.22	unknown	via CMAUP database
2-Nonenal	5283335	Click to see CCCCCCC=CC=O	140.22	unknown	https://doi.org/10.1002/CBDV.201300390
2,6-Dimethyl-5-heptenal	61016	Click to see CC(CCC=C(C)C)C=O	140.22	unknown	https://doi.org/10.1002/CBDV.201300390
Dec-2-enal	19801	Click to see CCCCCCCC=CC=O	154.25	unknown	https://doi.org/10.1021/JF60160A012
Dodecanal	8194	Click to see CCCCCCCCCCCC=O	184.32	unknown	https://doi.org/10.1021/JF60198A031 https://doi.org/10.1021/JF60160A012
Heptanal	8130	Click to see CCCCCCC=O	114.19	unknown	https://doi.org/10.1021/JF60160A012
Hexanal	6184	Click to see CCCCCC=O	100.16	unknown	via CMAUP database
Non-2-enal	17166	Click to see CCCCCCC=CC=O	140.22	unknown	https://doi.org/10.1021/JF60160A012 https://doi.org/10.1021/JF60198A031
Nonanal	31289	Click to see CCCCCCCCC=O	142.24	unknown	https://doi.org/10.1021/JF60198A031 https://doi.org/10.1021/JF60160A012
Octanal	454	Click to see CCCCCCCC=O	128.21	unknown	https://doi.org/10.1021/JF60160A012 https://doi.org/10.1002/CBDV.201300390
Undecanal	8186	Click to see CCCCCCCCCCC=O	170.29	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Alpha,beta-unsaturated ketones / Enones
3,3,6-Trimethylhepta-1,5-dien-4-one	68346	Click to see CC(=CC(=O)C(C)(C)C=C)C	152.23	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Alpha,beta-unsaturated ketones / Ynones
3,7-Dimethyloct-6-en-1-yn-3-ol	62842	Click to see CC(=CCCC(C)(C#C)O)C	152.23	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Benzoquinones / P-benzoquinones
2,5-Dihydroxy-3,6-diphenyl-p-benzoquinone	11056	Click to see C1=CC=C(C=C1)C2=C(C(=O)C(=C(C2=O)O)C3=CC=CC=C3)O	292.30	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Cyclic ketones / Cyclohexenones
(R)-4-Isopropylcyclohex-2-enone	642520	Click to see CC(C)C1CCC(=O)C=C1	138.21	unknown	via CMAUP database
4-Isopropyl-2-cyclohexenone	92780	Click to see CC(C)C1CCC(=O)C=C1	138.21	unknown	via CMAUP database
Dehydrosabinaketone	527426	Click to see CC(C)C12CC1C(=O)C=C2	136.19	unknown	https://doi.org/10.1002/CBDV.201300390
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones
2-Heptanone	8051	Click to see CCCCCC(=O)C	114.19	unknown	https://doi.org/10.1002/CBDV.201300390
3-Octanone	246728	Click to see CCCCCC(=O)CC	128.21	unknown	https://doi.org/10.1002/CBDV.201300390
5-Isopropylbicyclo[3.1.0]hexan-2-one	92784	Click to see CC(C)C12CCC(=O)C1C2	138.21	unknown	https://doi.org/10.1002/CBDV.201300390
6-Methyl-5-hepten-2-one	9862	Click to see CC(=CCCC(=O)C)C	126.20	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Phenylketones / Alkyl-phenylketones
Paeonol	11092	Click to see CC(=O)C1=C(C=C(C=C1)OC)O	166.17	unknown	https://doi.org/10.1271/NOGEIKAGAKU1924.63.185
> Organoheterocyclic compounds / Benzodioxoles
Apiole	10659	Click to see COC1=C2C(=C(C(=C1)CC=C)OC)OCO2	222.24	unknown	https://doi.org/10.1002/CBDV.201300390
Myristicin	4276	Click to see COC1=CC(=CC2=C1OCO2)CC=C	192.21	unknown	https://doi.org/10.1021/JF00110A025 https://doi.org/10.1021/JF60220A043 https://doi.org/10.1002/CBDV.201300390 https://doi.org/10.1021/JF60160A012
> Organoheterocyclic compounds / Benzopyrans / 1-benzopyrans / Chromones
Eugenin	10189	Click to see CC1=CC(=O)C2=C(C=C(C=C2O1)OC)O	206.19	unknown	https://doi.org/10.1021/JF034085+
> Organoheterocyclic compounds / Benzopyrans / 2-benzopyrans
3-Methyl-6-methoxy-8-hydroxy-3,4-dihydroisocoumarin	93040	Click to see CC1CC2=C(C(=CC(=C2)OC)O)C(=O)O1	208.21	unknown	https://doi.org/10.1021/JF034085+
6-Methoxymellein	83412	Click to see CC1CC2=C(C(=CC(=C2)OC)O)C(=O)O1	208.21	unknown	https://doi.org/10.1016/0885-5765(87)90083-X https://doi.org/10.1016/0031-9422(91)85021-Q https://www.ncbi.nlm.nih.gov/pmc/articles/PMC158745/ https://doi.org/10.1016/0048-4059(84)90039-0 https://doi.org/10.1016/S0031-9422(00)81047-X https://doi.org/10.1016/S0031-9422(00)86874-0 https://doi.org/10.1016/S0031-9422(00)90347-9 https://doi.org/10.1016/S0031-9422(00)86959-9
Angelicoin B	11629832	Click to see CC1CC2=C(C(=CC(=C2)OC)O)C(=O)O1	208.21	unknown	https://doi.org/10.1021/JF034085+
> Organoheterocyclic compounds / Dihydrofurans / Furanones / Butenolides
3,6-Diphenylfuro[3,2-b]furan-2,5-dione	72617	Click to see C1=CC=C(C=C1)C2=C3C(=C(C(=O)O3)C4=CC=CC=C4)OC2=O	290.30	unknown	via CMAUP database
Ascorbic Acid	54670067	Click to see C(C(C1C(=C(C(=O)O1)O)O)O)O	176.12	unknown	https://doi.org/10.1111/J.1365-2621.1995.TB05668.X
Z-6,7-Epoxyligustilide	5317139	Click to see CCCC=C1C2=C(C3C(O3)CC2)C(=O)O1	206.24	unknown	via CMAUP database
> Organoheterocyclic compounds / Epoxides
2,2-Dimethyl-3-(3-methylenepent-4-enyl)oxirane	122371	Click to see CC1(C(O1)CCC(=C)C=C)C	152.23	unknown	via CMAUP database
Humulene epoxide	5352470	Click to see CC1=CCCC2(C(O2)CC(C=CC1)(C)C)C	220.35	unknown	https://doi.org/10.1002/CBDV.201300390
> Organoheterocyclic compounds / Imidazopyrimidines / Purines and purine derivatives / 6-aminopurines / 6-alkylaminopurines
N-(3-Methylbut-2-EN-1-YL)-9H-purin-6-amine	92180	Click to see CC(=CCNC1=NC=NC2=C1NC=N2)C	203.24	unknown	https://doi.org/10.1016/S0176-1617(87)80045-7
> Organoheterocyclic compounds / Isocoumarans
[(1S,2S)-1-(7-methoxy-1,3-dihydro-2-benzofuran-5-yl)-1-[(Z)-2-methylbut-2-enoyl]oxypropan-2-yl] (Z)-2-methylbut-2-enoate	163187936	Click to see CC=C(C)C(=O)OC(C)C(C1=CC2=C(COC2)C(=C1)OC)OC(=O)C(=CC)C	388.50	unknown	https://doi.org/10.1007/S10600-010-9479-7
[1-(7-Methoxy-1,3-dihydro-2-benzofuran-5-yl)-1-(2-methylbut-2-enoyloxy)propan-2-yl] 2-methylbut-2-enoate	162933858	Click to see CC=C(C)C(=O)OC(C)C(C1=CC2=C(COC2)C(=C1)OC)OC(=O)C(=CC)C	388.50	unknown	https://doi.org/10.1007/S10600-010-9479-7
> Organoheterocyclic compounds / Lactones / Gamma butyrolactones
(5S)-5-hexyloxolan-2-one	7057904	Click to see CCCCCCC1CCC(=O)O1	170.25	unknown	via CMAUP database
Gamma-Decalactone	12813	Click to see CCCCCCC1CCC(=O)O1	170.25	unknown	via CMAUP database
> Organoheterocyclic compounds / Oxanes
(1S,2S,5R,8R)-5,8-dimethyl-2-propan-2-yl-11-oxatricyclo[6.2.1.01,5]undecane	162858197	Click to see CC(C)C1CCC2(C13CCC(O3)(CC2)C)C	222.37	unknown	https://doi.org/10.1016/0031-9422(89)80071-8
1H-3a,6-Epoxyazulen-7-ol, octahydro-6,8a-dimethyl-3-(1-methylethyl)-, [3R-(3alpha,3aalpha,6alpha,7beta,8aalpha)]-	6432757	Click to see CC(C)C1CCC2(C13CCC(O3)(C(C2)O)C)C	238.37	unknown	via CMAUP database
5,8-Epoxydaucane	323964	Click to see CC(C)C1CCC2(C13CCC(O3)(CC2)C)C	222.37	unknown	https://doi.org/10.1016/0031-9422(89)80071-8
Daucol	442363	Click to see CC(C)C1CCC2(C13CCC(O3)(C(C2)O)C)C	238.37	unknown	https://doi.org/10.1002/(SICI)1099-1026(199909/10)14:5<268::AID-FFJ823>3.0.CO;2-Z https://doi.org/10.1002/CBDV.201300390
Eucalyptol	2758	Click to see CC1(C2CCC(O1)(CC2)C)C	154.25	unknown	via CMAUP database
> Organoheterocyclic compounds / Oxepanes
(1R,2S,3S,5R,6R,8R)-1,5,9,9-tetramethyl-10-oxatricyclo[6.2.2.02,6]dodecane-3,8-diol	163193860	Click to see CC1CC(C2C1CC3(CCC2(OC3(C)C)C)O)O	254.36	unknown	https://doi.org/10.1016/J.FITOTE.2009.12.008
(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
1,5,9,9-Tetramethyl-10-oxatricyclo[6.2.2.02,6]dodecane-3,8-diol	75229609	Click to see CC1CC(C2C1CC3(CCC2(OC3(C)C)C)O)O	254.36	unknown	https://doi.org/10.1016/J.FITOTE.2009.12.008
Carvone oxide	11030188	Click to see CC(=C)C1CC2C(O2)(C(=O)C1)C	166.22	unknown	via CMAUP database
> Organoheterocyclic compounds / Oxolanes
10-Epi-italicene ether	91747401	Click to see CC1CCC2C13CCC(=CC3OC2(C)C)C	220.35	unknown	via CMAUP database
> Organoheterocyclic compounds / Pyrrolidines
Pyrrolidine	31268	Click to see C1CCNC1	71.12	unknown	via CMAUP database
> Organoheterocyclic compounds / Tetrahydrofurans
Linalool oxide	22310	Click to see CC1(CCC(O1)C(C)(C)O)C=C	170.25	unknown	via CMAUP database
trans-Linalool oxide	6432254	Click to see CC1(CCC(O1)C(C)(C)O)C=C	170.25	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Cinnamaldehydes
Cinnamaldehyde	637511	Click to see C1=CC=C(C=C1)C=CC=O	132.16	unknown	via CMAUP database
cis-Cinnamaldehyde	6428995	Click to see C1=CC=C(C=C1)C=CC=O	132.16	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Cinnamic acids
Cinnamic acid	444539	Click to see C1=CC=C(C=C1)C=CC(=O)O	148.16	unknown	https://doi.org/10.1515/ZNC-1983-5-613
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives / Coumaric acids
cis-2-Coumarate	54714352	Click to see C1=CC=C(C(=C1)C=CC(=O)O)[O-]	163.15	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Coumarins and derivatives
Coumarin	323	Click to see C1=CC=C2C(=C1)C=CC(=O)O2	146.14	unknown	via CMAUP database
Osthol	10228	Click to see CC(=CCC1=C(C=CC2=C1OC(=O)C=C2)OC)C	244.28	unknown	https://doi.org/10.1007/BF00575189
Thamnosmonin	312089	Click to see CC(=C)C(C(C1=C(C=C2C(=C1)C=CC(=O)O2)OC)O)O	276.28	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Coumarins and derivatives / Furanocoumarins / Angular furanocoumarins
2-[(8S)-2-oxo-8,9-dihydrofuro[2,3-h]chromen-8-yl]propan-2-yl (Z)-2-methylbut-2-enoate	53399217	Click to see CC=C(C)C(=O)OC(C)(C)C1CC2=C(O1)C=CC3=C2OC(=O)C=C3	328.40	unknown	https://doi.org/10.1007/BF00575189
Columbianadin	6436246	Click to see CC=C(C)C(=O)OC(C)(C)C1CC2=C(O1)C=CC3=C2OC(=O)C=C3	328.40	unknown	https://doi.org/10.1007/BF00575189
> 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/10.1021/JF00111A001
(+)-Oxypeucedanin	928465	Click to see CC1(C(O1)COC2=C3C=CC(=O)OC3=CC4=C2C=CO4)C	286.28	unknown	https://doi.org/10.1021/JF00111A001
9-[[(2S)-3,3-dimethyloxiran-2-yl]methoxy]furo[3,2-g]chromen-7-one	17897	Click to see CC1(C(O1)COC2=C3C(=CC4=C2OC=C4)C=CC(=O)O3)C	286.28	unknown	https://doi.org/10.1021/JF00111A001
Heraclenin	458010	Click to see CC1(C(O1)COC2=C3C(=CC4=C2OC=C4)C=CC(=O)O3)C	286.28	unknown	https://doi.org/10.1021/JF00111A001
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/10.1021/JF00111A001
Pentosalen	10212	Click to see CC(=CCOC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2)C	270.28	unknown	https://doi.org/10.1021/JF00111A001
Peucedanin	8616	Click to see CC(C)C1=C(C2=C(O1)C=C3C(=C2)C=CC(=O)O3)OC	258.27	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/10.1016/S0031-9422(00)94506-0 https://doi.org/10.1021/JF00111A001
> Phenylpropanoids and polyketides / Coumarins and derivatives / Furanocoumarins / Psoralens / 5-methoxypsoralens
Bergapten	2355	Click to see COC1=C2C=CC(=O)OC2=CC3=C1C=CO3	216.19	unknown	https://doi.org/10.1016/S0031-9422(00)94506-0 https://doi.org/10.1139/B93-109 https://doi.org/10.1007/BF00575189 https://doi.org/10.1021/JF00111A001
> 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	https://doi.org/10.1021/JF00111A001
Methoxsalen	4114	Click to see COC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2	216.19	unknown	https://doi.org/10.1016/S0031-9422(00)94506-0 https://doi.org/10.1021/JF00111A001
> Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins / 7-hydroxycoumarins
3,4,5,6,8-Pentadeuterio-7-hydroxychromen-2-one	45358955	Click to see C1=CC(=CC2=C1C=CC(=O)O2)O	167.17	unknown	via CMAUP database
Umbelliferone	5281426	Click to see C1=CC(=CC2=C1C=CC(=O)O2)O	162.14	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavones
Apigenin	5280443	Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O	270.24	unknown	https://doi.org/10.1055/S-2008-1074990 https://doi.org/10.1002/JSFA.1820 https://doi.org/10.1016/0031-9422(93)85092-6 https://doi.org/10.1016/0305-1978(94)90062-0 https://doi.org/10.1007/BF02903720
Chrysin	5281607	Click to see C1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O	254.24	unknown	https://doi.org/10.1016/0031-9422(93)85092-6
Luteolin	5280445	Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O)O	286.24	unknown	https://doi.org/10.1016/0031-9422(93)85092-6 https://doi.org/10.1016/0305-1978(94)90062-0 https://doi.org/10.1007/BF02903720
> 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	https://doi.org/10.1016/0031-9422(93)85092-6 https://doi.org/10.1556/AALIM.29.2000.4.4
Myricetin	5281672	Click to see C1=C(C=C(C(=C1O)O)O)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O	318.23	unknown	https://doi.org/10.1002/JSFA.1820
Quercetin	5280343	Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O	302.23	unknown	https://doi.org/10.1016/0031-9422(93)85092-6
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Anthocyanins / Anthocyanidin-3-O-glycosides
(2S,5S)-2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromenylium-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol	44256715	Click to see C1=CC(=C(C=C1C2=[O+]C3=CC(=CC(=C3C=C2OC4C(C(C(C(O4)CO)O)O)O)O)O)O)O	449.40	unknown	https://doi.org/10.1021/NP50022A003
Cyanidin 3-glucogalactoside	131751173	Click to see C1=CC(=C(C=C1C2=[O+]C3=CC(=CC(=C3C=C2OC4C(C(C(C(O4)COC5C(C(C(C(O5)CO)O)O)O)O)O)O)O)O)O)O	611.50	unknown	https://doi.org/10.1021/NP50022A003
Kuromanin	441667	Click to see C1=CC(=C(C=C1C2=[O+]C3=CC(=CC(=C3C=C2OC4C(C(C(C(O4)CO)O)O)O)O)O)O)O	449.40	unknown	https://doi.org/10.1016/S0308-8146(00)00104-7
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glucuronides / Flavonoid-7-O-glucuronides
Luteolin 7-glucuronide	5280601	Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)C(=O)O)O)O)O)O)O)O	462.40	unknown	https://doi.org/10.1016/0031-9422(88)80745-3
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides
5,7-Dihydroxy-2-(4-hydroxyphenyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one	5462193	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	https://doi.org/10.1007/S10600-010-9479-7
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	https://doi.org/10.1007/S10600-010-9479-7
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)85092-6
Vitamin P	5293655	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O	610.50	unknown	https://doi.org/10.1016/0031-9422(93)85092-6
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-7-O-glycosides
Apigetrin	5280704	Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O	432.40	unknown	https://doi.org/10.1016/0305-1978(94)90062-0
Isorhoifolin	9851181	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)O)O)O)O)O)O)O)O	578.50	unknown	https://doi.org/10.1016/0305-1978(94)90062-0
Luteolin 7-O-glucoside	5280637	Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O)O	448.40	unknown	https://doi.org/10.1016/0305-1978(94)90062-0 https://doi.org/10.3136/FSTR.7.307 https://doi.org/10.1016/0031-9422(88)80745-3
Scolymoside	5282152	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)O)CO)O)O)O)O)O	594.50	unknown	https://doi.org/10.1016/0305-1978(94)90062-0
Thermopsoside	11294177	Click to see COC1=C(C=CC(=C1)C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O	462.40	unknown	https://doi.org/10.3136/FSTR.7.307
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 3-O-methylated flavonoids
Chryseriol	5280666	Click to see COC1=C(C=CC(=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O	300.26	unknown	https://doi.org/10.1055/S-2008-1074990
> Phenylpropanoids and polyketides / Macrolactams
Desferrioxamine X5	85625752	Click to see C1CCCN(C(=O)CCC(=O)NCCCCCN(C(=O)CCC(=O)NCCCCCNC(=O)CCC(=O)NCC1)O)O	598.70	unknown	https://doi.org/10.1007/BF00390811
> Phenylpropanoids and polyketides / Macrolides and analogues
Avermectin A1b	9940924	Click to see CC1C=CC=C2COC3C2(C(C=C(C3OC)C)C(=O)OC4CC(CC=C(C1OC5CC(C(C(O5)C)OC6CC(C(C(O6)C)O)OC)OC)C)OC7(C4)C=CC(C(O7)C(C)C)C)O	873.10	unknown	https://doi.org/10.1021/NP50022A003
Carpaine	442630	Click to see CC1C2CCC(N1)CCCCCCCC(=O)OC3CCC(CCCCCCCC(=O)O2)NC3C	478.70	unknown	via CMAUP database

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Daucus carota

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