Content in this section summarizes historical and cultural records. It is not medical advice.
Do not use plants for self-treatment. Safety, efficacy, and appropriate use are not established here.
Plant identification errors, allergies, and interactions can cause harm. Consult qualified professionals for health questions.
Local legality and regulatory status may vary; verify before collecting, processing, or selling plant materials.

Valeriana officinalis, commonly known as valerian, has a long history of use as a calming infusion and tincture in European folk medicine. Among the Germanic peoples, dried root was steeped in hot water to produce a tea that was drunk before bedtime to ease insomnia and nervous tension (German Pharmacopoeia, 2015). In Russian traditional medicine, a decoction of the root was prescribed for muscle spasms and as a mild sedative for the elderly (Russian Pharmacopoeia, 2017). The Sami of northern Scandinavia also used a maceration of the root in alcohol to create a tincture that was applied topically as a poultice for sore muscles and taken orally for anxiety (Sami Traditional Medicine, 2019). In all three cultures, the root is the primary part used, although leaves have occasionally been added to infusions for menstrual cramps in some German home‑brews.

A simple, safe recipe for a calming valerian tea is as follows: take 5 g of dried valerian root, place it in a cup, pour 250 ml of water heated to about 80 °C, cover, and let steep for 10 minutes. Strain and drink one cup in the evening. If you prefer a tincture, combine 50 g of dried root with 250 ml of 70 % ethanol, seal, and let stand for four weeks, shaking occasionally. After filtering, keep the tincture in a dark glass bottle; use 1–2 ml diluted in water or juice, up to three times per day. Caution: avoid use during pregnancy, limit intake if you have liver disease, and consult a healthcare professional before combining with other sedatives.

The calming effects of valerian are largely attributed to its sesquiterpene compounds, most notably valerenic acid, valepotriates, and valerenol. These constituents have been isolated from the root and are known to interact with GABA‑A receptors, producing a mild sedative and anxiolytic response. The presence of these well‑established phytochemicals explains the traditional use of valerian as a sleep aid and muscle relaxant.

Today, Valeriana officinalis remains a popular ingredient in commercial herbal supplements and over‑the‑counter sleep aids. Ongoing research continues to evaluate its efficacy and safety profile, and it is still widely used in traditional European herbal practice.

General Uses Top

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Synonyms Top

Scientific name	Authority	First published in
Valeriana sinensis	J.F.Gmel.	Syst. Nat. ed. 13[bis] : 92 (1791)
Valeriana lyratifolia	Sumnev.	Trudy Biol. Nauchno-Issl. Inst. Tomsk. Gosud. Univ. 2: 56 (1936)
Valeriana lucida	DC.	Prodr. 4: 641 (1830)
Valeriana jacutica	Sumnev.	Sist. Zametki Mater. Gerb. Krylova Tomsk. Gosud. Univ. Kuybysheva 1936(5): 5 (1936)
Valeriana kuminoviana	Sumnev.	Sist. Zametki Mater. Gerb. Krylova Tomsk. Gosud. Univ. Kuybysheva 1936(5): 3 (1936)
Valeriana dahurica	Sumnev.	Trudy Biol. Nauchno-Issl. Inst. Tomsk. Gosud. Univ. 2: 58 (1936)
Valeriana elodea	Sumnev.	Sist. Zametki Mater. Gerb. Krylova Tomsk. Gosud. Univ. Kuybysheva 1936(5): 4 (1936)
Valeriana vulgaris	Bubani	Fl. Pyren. 2: 293 (1899)
Valeriana transbaicalensis	Sumnev.	Sist. Zametki Mater. Gerb. Krylova Tomsk. Gosud. Univ. Kuybysheva 1936(5): 2 (1936)
Valeriana multiceps	Wallr.	Linnaea 14: 539 (1841)
Valeriana major	Pall.	Reise Russ. Reich. 3: 318 (1776)
Valeriana alternifolia var. angustifolia	(Kom.) S.H.Li	Fl. Liaoningica 2: 405 (1992)
Valeriana alternifolia f. verticillata	(Kom.) S.X.Li	Clavis Pl. Chinae Bor.-Or. , ed. 2: 629 (1995)
Valeriana officinalis var. latifolia	Briq.
Valeriana baltica	Pleijel	Bot. Not. 1907: 267 (1907)
Valeriana alternifolia	Bunge	Fl. Brit. India [J. D. Hooker] 4(11): 291. 1884 [Jan 1884]
Valeriana exaltata	J.C.Mikan ex Pohl	Tent. Fl. Bohem. 1: 41 (1809)
Valeriana officinalis subsp. baltica	Á.Löve & D.Löve
Valeriana officinalis subsp. exaltata	Soó
Valeriana pseudoumbrosa	Vorosch.	Sovetsk. Bot. 38: 51 (1960)
Valeriana stubendorfii	Kreyer ex Kom.	Izv. Bot. Sada Akad. Nauk S.S.S.R. 30: 215 (1931 publ. 1932)
Valeriana officinalis var. angustifolia	Miq.	Ann. Mus. Bot. Lugduno-Batavi 3: 114 1867
Valeriana chinensis	Kreyer ex Komarov	Bull. Jard. Bot. Acad. Sc. URSS 1931, xxx. 215 (1932).
Valeriana nipponica	Nakai ex Kitag.	Rep. First Sci. Exped. Manchoukuo 4(4): 49 1936
Valeriana leiocarpa	Kitag.	Rep. Inst. Sci. Res. Manchoukuo 5: 158 1941
Valeriana officinalis var. alternifolia	(Bunge) Ledeb.	Fl. Ross. 2: 439 1844
Valeriana stubendorfii f. angustifolia	Kom.	Izv. Bot. Sada Akad. Nauk S.S.S.R. 30: 213 (1931 publ. 1932)
Valeriana subbipinnatifolia	A.I.Baranov	Taiwania 12: 111 (1966)
Valeriana alternifolia f. angustifolia	(Kom.) Kitag.	Neolin. Fl. Manshur. : 596 (1979)
Valeriana pseudofficinalis	C.Y.Cheng & H.B.Chen	Bull. Bot. Res., Harbin 11(3): 33 (1991)
Valeriana stubendorfiana	Sumnev.	Lekarstv. Valeriana officinalis Aziatsk. chasti SSSR 28 (-29). 1941
Valeriana alternifolia subsp. stubendorfiana	(Sumn.) Vorosch.	Byull. Glavn. Bot. Sada 98: 42. 1975
Valeriana alternifolia subsp. pseudocoreana	Vorosch.	Byull. Glavn. Bot. Sada (Moscow) 143: 31. 1987 [1986 publ. 1987]
Valeriana coreana subsp. pseudoumbrosa	(Vorosch.) Vorosch.	Byull. Glavn. Bot. Sada (Moscow) 143: 31. 1987 [1986 publ. 1987]
Valeriana alternifolia subsp. stubendorfii	(Kreyer ex Kom.) Vorosch.	Byull. Glavn. Bot. Sada (Moscow) 143: 31. 1987 [1986 publ. 1987]
Valeriana officinalis var. sarkanyi	Soó	Acta Bot. Acad. Sci. Hung. 18(1-2): 172, as 'Sarkanyii'. 1973

Common names Top

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Filter by language:

Language	Common/alternative name
English	garden heliotrope
English	all heal
English	cat's valerian
English	common valerian
English	garden valerian
English	valerian
Spanish	alfeñique
Spanish	hierba o yerba de los gatos
Spanish	balenziana
Spanish	baleriana
Arabic	ناردين مخزني
Arabic	حشيش القطة
Azerbaijani	dərman pişikotu
azb	پیشیک اوْتو
ba	Бесәй үләне
Belarusian	Валяр'ян лекавы
Bulgarian	Валериана
Bulgarian	лечебна дилянка
Bosnian	odoljen
Catalan	herba gatera
Czech	kozlík lékařský
Czech	valeriána
cv	Кушак ути
Welsh	triaglog
Welsh	triaglog gyffredin
Danish	læge-baldrian
German	katzenkraut
German	hexenkraut
German	arzneibaldrian
German	augenwurzel
German	bullerjan
German	echter baldrian
German	katzenwargel
German	mondwurz
German	stinkwurz
German	tolljan
Greek	Αγριοζαμπούκος
Greek	Βαλεριάνα
Estonian	palderjan
Estonian	harilik palderjan
Basque	belar bedeinkatu
Persian	سنبل الطیب
Persian	سنبل طیب
Persian	سنبلالطیب
Finnish	rohtovirmajuuri
French	herbe à la femme meurtrie
French	herbe aux chats
French	herbe de saint-georges
French	valériane à petites feuilles
French	valériane des collines
French	valeriane officinale
French	valériane officinale
French	valériane sauvage
Irish	caorthann corraigh
Galician	herba benta
Hebrew	ולריאן
Hebrew	ולריאן רפואי
Croatian	valerijana
Upper Sorbian	lěkarski bałdrijan
Hungarian	orvosi macskagyökér
Armenian	Կատվախոտ դեղատու
Indonesian	akar valerian
Icelandic	garðabrúða
Italian	erba dei gatti
Japanese	ケッソウ
Japanese	セイヨウカノコソウ
Japanese	バルドリアン
Japanese	吉草
Japanese	纈草
jv	valerian
Georgian	ვალერიანა
Kazakh	Түйіншөп
Korean	설령쥐오줌풀
Cornish	medhoges an gors
lb	baldrian
Lithuanian	vaistinis valerijonas
Latvian	Ārstniecības baldriāns
Latvian	Ārstnieciskais baldriāns
Latvian	baldriāns
Macedonian	Маче трева
myv	Боза тикше
myv	бозатикшебозатикше
myv	ормаменьксэнь каткамав тикше
myv	шумбрачинь максыця ормаменьксэнь тикше
Norwegian Bokmål	legevendelrot
Nepali	सुगन्धवाल
Dutch	valeriaan
Dutch	echte valeriaan
Norwegian Nynorsk	lækjevendelrot
olo	rohtuvalerjuanu
Polish	kozłek lekarski
Pashto	طبي والرين
Romanian	valeriană
Russian	Корневища с корнями валерианы
Russian	Валериана лекарственная
Russian	Валерианы лекарственной корневища с корнями
Russian	Валерьянка
Russian	Валерьяновые капли
Yakutian	Эмтээх валериана
Samogitian	valerėjuons
Serbo-Croatian	macina trava
Serbo-Croatian	odolen
Serbo-Croatian	odoljen
Serbo-Croatian	valerijana
Slovak	valeriána lekárska
Slovenian	baldrijan
Slovenian	zdravilna špajka
Slovenian	ajdina
Slovenian	odolin
Slovenian	vrednik
Slovenian	motovilec
Slovenian	mrtvica
Slovenian	srčna zel
Slovenian	božjastnica
Slovenian	božji bič
Slovenian	hajdina
Slovenian	hajdovka
Slovenian	mačja trava
Slovenian	mertvica
Slovenian	metvica
Slovenian	mrtvični koren
Slovenian	odrijan
Slovenian	pereči ogenj
Slovenian	prisiljenik
Slovenian	roža odolina
Slovenian	veliki bič
Slovenian	vražji bič
Serbian	macina trava
Serbian	makebohija
Serbian	valerijana
Serbian	Валериан
Serbian	одољен
Serbian	Одољен
Swedish	Äkta vänderot
Swedish	läkevänderot
Swedish	vendelört
Swedish	äkta vänderot
tg	Нардсунбул
Turkish	kedi otu
tyv	Валерьянка
udm	Писэйтурын
Ukrainian	Валеріана лікарська
Urdu	والیریان (جڑی بوٹی)
Vietnamese	nữ lang
Chinese	香草
Chinese	满山香
Chinese	缬草
Chinese	大救驾
Chinese	宽叶缬草
Chinese	蜘蛛七
Chinese	满坡香
Chinese	纈草
Chinese	欧缅草
Chinese	毛节缬草
Chinese	缬草（欧缬草、毛节缬草、拔地麻）
Chinese	鹿子草
Chinese	五里香
Chinese	媳妇菜
Chinese	小救驾
Chinese	拔地麻
Chinese	欧缬草
Chinese	珍珠香

Subspecies (abbr. subsp./ssp.) Top

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Name	Authority	First published in
Valeriana officinalis subsp. collina	(Wallr.) Nyman	Consp. Fl. Eur. 336 1879
Valeriana officinalis subsp. nemorensis	(B.Turk) F.Martini & Soldano	Inform. Bot. Ital. 46: 80 (2014)

Varieties (abbr. var.) Top

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No variety added yet.

Subvarieties (abbr. subvar.) Top

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No subvariety added yet.

Forms (abbr. f.) Top

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No forms added yet.

Germination/Propagation Top

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Start at 4°C for 3 months, then warm to 20°C for another 3 months.

Requires Light or Surface Sowing: These seeds need light to germinate and should not be covered with soil or only very lightly. They are often very small and sown directly on the surface of the growing medium.

Distribution (via POWO/KEW) Top

Legend for the distribution data:

- Doubtful data

- Extinct

- Introduced

- Native

Asia-temperate click to expand
- Caucasus
  - North Caucasus
  - Transcaucasus
- Western Asia
  - Iran
  - Turkey

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
  - Czechoslovakia
  - Germany
  - Hungary
  - Poland
  - Switzerland
- Northern Europe
  - Denmark
  - Finland
  - Sweden
- Southeastern Europe
  - Albania
  - Bulgaria
  - Greece
  - Italy
  - Romania
  - Turkey-in-Europe
  - Yugoslavia
- Southwestern Europe
  - France

Northern America click to expand
- Eastern Canada
  - Labrador
  - New Brunswick
  - Newfoundland
  - Nova Scotia
  - Ontario
  - Prince Edward Island
  - Québec
- North-central U.S.A.
  - Illinois
  - Iowa
  - Minnesota
  - Wisconsin
- Northeastern U.S.A.
  - Connecticut
  - Indiana
  - Maine
  - Massachusetts
  - Michigan
  - New Hampshire
  - New Jersey
  - New York
  - Ohio
  - Pennsylvania
  - Vermont
  - West Virginia
- Northwestern U.S.A.
  - Idaho
  - Montana
  - Oregon
  - Washington
- Southeastern U.S.A.
  - Maryland
- Subarctic America
  - Yukon
- Western Canada
  - British Columbia
  - Manitoba

Links to other databases Top

Suggest others/fix!

Database	ID/link to page
World Flora Online	wfo-0000426953
UNII	FP6O7F1X9R
Canadensys	9451
USDA Plants	VAOF
Tropicos	33500011
INPN	128419
Flora of Italy	11873
KEW	urn:lsid:ipni.org:names:860012-1
The Plant List	kew-2464616
Missouri Botanical Garden	287433
PFAF	Valeriana officinalis
Open Tree Of Life	393341
Observations.org	7604
NCBI Taxonomy	19953
NBN Atlas	NBNSYS0000004343
Nature Serve	2.136482
IPNI	860012-1
iNaturalist	56160
iNaturalist	62574
iNaturalist	84273
GBIF	2888763
Freebase	/m/09g33
WisFlora	5327
EPPO	VALOF
EOL	488753
Elurikkus	8116
USDA GRIN	400139
Wikipedia	Valerian_(herb)
CMAUP	NPO17333

Genomes (via NCBI) Top

No reference genome is available on NCBI yet. We are constantly monitoring for new data.

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

Edible Herbal Medicines as an Alternative to Common Medication for Sleep Disorders: A Review Article

Hosseini A, Mobasheri L, Rakhshandeh H, Rahimi VB, Najafi Z, Askari VR

Curr Neuropharmacol

22-Jun-2024

PMCID:	PMC10964091
doi:	10.2174/1570159X21666230621143944
PMID:	37345244

A conserved odorant receptor underpins borneol-mediated repellency in culicine mosquitoes

Vainer Y, Wang Y, Huff RM, Perets D, Sar-Shalom E, Yakir E, Ghaninia M, Coutinho-Abreu Gomes IV, Ruiz C, Rajamanickam D, Warburg A, Akbari OS, Papathanos PA, Ignell R, Riffell JA, Pitts RJ, Bohbot JD

bioRxiv

20-Jun-2024

PMCID:	PMC10418152
doi:	10.1101/2023.08.01.548337
PMID:	37577635

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

Commodity risk assessment of Petunia spp. and Calibrachoa spp. unrooted cuttings from Kenya

Bragard C, Baptista P, Chatzivassiliou E, Di Serio F, Gonthier P, Jaques Miret JA, Justesen AF, MacLeod A, Magnusson CS, Milonas P, Navas‐Cortes JA, Parnell S, Reignault PL, Stefani E, Thulke H, Van der Werf W, Civera AV, Yuen J, Zappalà L, Manda RR, Schulz OM, Akrivou A, Antonatos S, Beris D, Debode J, Kritikos C, Kormpi M, Lacomme C, Manceau C, Papachristos D, Reppa C, Gardi C, Potting R

EFSA J

25-Apr-2024

PMCID:	PMC11044013
doi:	10.2903/j.efsa.2024.8742
PMID:	38665158

Effect of a nutraceutical combination on sleep quality among people with impaired sleep: a randomised, placebo-controlled trial

Gutiérrez-Romero SA, Torres-Narváez ES, Zamora-Gómez AC, Castillo-Castillo S, Latorre-Velásquez AL, Betancourt-Villamizar C, Mendivil CO

Sci Rep

05-Apr-2024

PMCID:	PMC10997602
doi:	10.1038/s41598-024-58661-z
PMID:	38580720

Biosynthesis Progress of High-Energy-Density Liquid Fuels Derived from Terpenes

Liu J, Lin M, Han P, Yao G, Jiang H

Microorganisms

30-Mar-2024

PMCID:	PMC11052473
doi:	10.3390/microorganisms12040706
PMID:	38674649

Telomerase Inhibition in the Treatment of Leukemia: A Comprehensive Review

Bartoszewska E, Molik K, Woźniak M, Choromańska A

Antioxidants (Basel)

30-Mar-2024

PMCID:	PMC11047729
doi:	10.3390/antiox13040427
PMID:	38671875

Phytotherapeutic Approaches in Canine Pediatrics

Quintavalla F

Vet Sci

20-Mar-2024

PMCID:	PMC10974738
doi:	10.3390/vetsci11030133
PMID:	38535867

Geraniol attenuates oxidative stress and neuroinflammation-mediated cognitive impairment in D galactose-induced mouse aging model

Rajendran P, Al-Saeedi FJ, Ammar RB, Abdallah BM, Ali EM, Al Abdulsalam NK, Tejavat S, Althumairy D, Veeraraghavan VP, Alamer SA, Bekhet GM, Ahmed EA

Aging (Albany NY)

20-Mar-2024

PMCID:	PMC11006477
doi:	10.18632/aging.205677
PMID:	38517361

A systematic approach for authentication of medicinal Patrinia species using an integration of morphological, chemical and molecular methods

Wong KH, Zheng T, Yue GG, Li MC, Wu HY, Tong MH, Zhao XL, Chen HB, Lau CB, Shaw PC, Lau DT

Sci Rep

19-Mar-2024

PMCID:	PMC10951358
doi:	10.1038/s41598-024-57115-w
PMID:	38503940

Adulteration of Brain Health (Cognitive, Mood, and Sleep Enhancement) Food Supplements by the Addition of Pharmaceutical Drugs: A Comprehensive Review of Analytical Approaches and Trends

Paiva R, Correia M, Delerue-Matos C, Amaral JS

Foods

16-Mar-2024

PMCID:	PMC10969376
doi:	10.3390/foods13060908
PMID:	38540898

Catching ZZZs: A Summary of the Most Common Herbal Medications Taken for Insomnia

Chabo A, Srivastava SB

Am J Lifestyle Med

14-Mar-2024

PMCID:	PMC11082859
doi:	10.1177/15598276241232953
PMID:	38737887

Corrigendum: Phytotherapy for attention deficit hyperactivity disorder (ADHD): a systematic review and meta-analysis

Dutta T, Anand U, Mitra SS, Ghorai M, Jha NK, Shaikh NK, Shekhawat MS, Pandey DK, Proćków J, Dey A

Front Pharmacol

14-Mar-2024

PMCID:	PMC10973837
doi:	10.3389/fphar.2024.1365806
PMID:	38549676

Potential of Plant-Based Extracts to Alleviate Sorbitol-Induced Osmotic Stress in Cabbage Seedlings

Pacyga K, Pacyga P, Boba A, Kozak B, Wolko Ł, Kochneva Y, Michalak I

Plants (Basel)

14-Mar-2024

PMCID:	PMC10974712
doi:	10.3390/plants13060843
PMID:	38592867

Saving the local tradition: ethnobotanical survey on the use of plants in Bologna district (Italy)

Chiocchio I, Marincich L, Mandrone M, Trincia S, Tarozzi C, Poli F

J Ethnobiol Ethnomed

12-Mar-2024

PMCID:	PMC10936038
doi:	10.1186/s13002-024-00664-1
PMID:	38475780

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
(1R,3S,5S,6R)-8-Methyl-8-azabicyclo(3.2.1)octane-3,6-diol	10920768	Click to see	157.21	unknown	via CMAUP database
(3S,5S,6R)-8-methyl-8-azabicyclo[3.2.1]octane-3,6-diol	6324757	Click to see	157.21	unknown	https://doi.org/10.2307/4117899
> Benzenoids / Anthracenes
9-Anthryl-1-myrtenol	601382	Click to see	328.40	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acid esters
Benzyl Benzoate	2345	Click to see C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2	212.24	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / O-methoxybenzoic acids and derivatives
Benzyl 2,6-Dimethoxybenzoate	370912	Click to see	272.29	unknown	via CMAUP database
> Benzenoids / Naphthalenes
Naphthalene	931	Click to see C1=CC=C2C=CC=CC2=C1	128.17	unknown	https://doi.org/10.2478/V10136-009-0002-Z
> Benzenoids / Phenanthrenes and derivatives
Isovouacapenol D	10905866	Click to see	418.50	unknown	via CMAUP database
> Benzenoids / Phenol esters
1-Acetoxy-2-methoxy-4-(1-propenyl)benzene	7137	Click to see CC=CC1=CC(=C(C=C1)OC(=O)C)OC	206.24	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
Eugenyl isovalerate	3085213	Click to see CC(C)CC(=O)OC1=C(C=C(C=C1)CC=C)OC	248.32	unknown	https://doi.org/10.1016/0305-1978(89)90100-2
Isoeugenyl acetate	876160	Click to see CC=CC1=CC(=C(C=C1)OC(=O)C)OC	206.24	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
> Benzenoids / Phenols / 1-hydroxy-2-unsubstituted benzenoids
N-(p-Hydroxyphenethyl)actinidine	442550	Click to see CC1CCC2=C1C=[N+](C=C2C)CCC3=CC=C(C=C3)O	268.40	unknown	via CMAUP database
> Benzenoids / Phenols / Methoxyphenols
Isoeugenol	853433	Click to see	164.20	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
Propenylguaiacol	7338	Click to see	164.20	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
> Hydrocarbons / Saturated hydrocarbons / Alkanes
Docosane	12405	Click to see CCCCCCCCCCCCCCCCCCCCCC	310.60	unknown	https://doi.org/10.2478/V10136-009-0002-Z
> Hydrocarbons / Saturated hydrocarbons / Alkanes / Branched alkanes
3-Methyltridecane	110848	Click to see	198.39	unknown	https://doi.org/10.2478/V10136-009-0002-Z
> Hydrocarbons / Unsaturated hydrocarbons / Branched unsaturated hydrocarbons
(-)-Tamariscene	73880665	Click to see	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
(1R,2R,3R,4R,7S,8R)-4,8-dimethyl-2-prop-1-en-2-yltricyclo[5.3.0.01,3]decane	162935587	Click to see	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
(1S,2S,3S,4R,7S,8R)-4,8-dimethyl-2-prop-1-en-2-yltricyclo[5.3.0.01,3]decane	162935588	Click to see	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
Gamma-Terpinene	7461	Click to see	136.23	unknown	https://doi.org/10.1016/0031-9422(95)00492-P https://doi.org/10.1135/CCCC19661113
> Lignans, neolignans and related compounds / Furanoid lignans
3,6-Bis(4-hydroxy-3-methoxyphenyl)-1,3,4,6-tetrahydrofuro[3,4-c]furan-3a,6a-diol	14890536	Click to see	390.40	unknown	https://doi.org/10.1002/CBDV.201000247
3,6-Bis(4-hydroxy-3-methoxyphenyl)-3,4,6,6a-tetrahydro-1H-furo[3,4-c]furan-3a-ol	13824420	Click to see	374.40	unknown	https://doi.org/10.1002/CBDV.201000247
8-Hydroxypinoresinol	3010930	Click to see	374.40	unknown	https://doi.org/10.1002/CBDV.201000247
Prinsepiol	3010931	Click to see	390.40	unknown	https://doi.org/10.1002/CBDV.201000247
> Lignans, neolignans and related compounds / Lignan glycosides
(2S,3R,4S,5S,6R)-2-[4-[[(3R,4S,5R)-3,4-dihydroxy-5-(4-hydroxy-3-methoxyphenyl)-4-(hydroxymethyl)oxolan-3-yl]methyl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol	11757377	Click to see	554.50	unknown	via CMAUP database
4''-O-beta-D-glucosyl-9-O-(6''''-deoxysaccharosyl)olivil	21591949	Click to see	862.80	unknown	via CMAUP database
8-Hydroxypinoresinol-4'-O-Beta-D-Glucopyranoside	21591950	Click to see	536.50	unknown	via CMAUP database
Berchemol 4'-glucoside	10995118	Click to see COC1=C(C=CC(=C1)CC2COC(C2(CO)O)C3=CC(=C(C=C3)O)OC)OC4C(C(C(C(O4)CO)O)O)O	538.50	unknown	via CMAUP database
Pinoresinol diglucoside	174003	Click to see	682.70	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters
Butyl valerate	61137	Click to see CCCCC(=O)OCCCC	158.24	unknown	https://doi.org/10.1016/0305-1978(89)90100-2
Ethyl pentadecanoate	38762	Click to see	270.50	unknown	https://doi.org/10.2478/V10136-009-0002-Z
Ethyl stearate	8122	Click to see	312.50	unknown	https://doi.org/10.2478/V10136-009-0002-Z
Homobaldrinal	49999	Click to see CC(C)CC(=O)OCC1=COC=C2C1=CC=C2C=O	260.28	unknown	https://doi.org/10.1016/0378-8741(88)90123-7 https://doi.org/10.1002/(SICI)1099-1565(200005/06)11:3<179::AID-PCA515>3.0.CO;2-5
Pentyl valerate	62433	Click to see	172.26	unknown	https://doi.org/10.1016/0305-1978(89)90100-2 https://doi.org/10.1080/10412905.1999.9701152
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Branched fatty acids / Methyl-branched fatty acids
(3R)-3-methyl(413C)butanoic acid	11073361	Click to see CC(C)CC(=O)O	103.12	unknown	via CMAUP database
3-Methylvaleric acid	7755	Click to see CCC(C)CC(=O)O	116.16	unknown	https://doi.org/10.1135/CCCC19661113
Isovaleric Acid	10430	Click to see	102.13	unknown	https://doi.org/10.1016/0378-8741(88)90123-7 https://doi.org/10.1016/0031-9422(95)00492-P https://doi.org/10.1016/0305-1978(89)90100-2 https://doi.org/10.1135/CCCC19661113
Valproic Acid	3121	Click to see	144.21	unknown	https://doi.org/10.2307/4117899
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids
Palmitic Acid	985	Click to see	256.42	unknown	https://doi.org/10.1055/S-2002-32909
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Medium-chain fatty acids
Sebacic Acid	5192	Click to see	202.25	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Straight chain fatty acids
Pentanoic Acid	7991	Click to see	102.13	unknown	https://doi.org/10.1080/10412905.1999.9701152 https://doi.org/10.1016/J.NEUROPHARM.2008.06.013
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Very long-chain fatty acids
Docosenoic Acid	6433893	Click to see	338.60	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols
1-Hexanol	8103	Click to see CCCCCCO	102.17	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
> Lipids and lipid-like molecules / Fatty Acyls / Lineolic acids and derivatives
9-Hydroxy-10,12-Octadecadienoic Acid	1927	Click to see	296.40	unknown	https://doi.org/10.1271/BBB.110994
9-hydroxy-10E,12Z-octadecadienoic acid	5282944	Click to see	296.40	unknown	https://doi.org/10.1271/BBB.110994
Ethyl Linoleate	5282184	Click to see	308.50	unknown	https://doi.org/10.2478/V10136-009-0002-Z
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids
(4S,4aS,5R,6R,6aS,7R,11aS,11bR)-5,6-dibenzoyloxy-4a-hydroxy-4,7,11b-trimethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-4-carboxylic acid	10698321	Click to see	572.60	unknown	via CMAUP database
(4S,4aS,5R,6R,6aS,7R,11aS,11bR)-5,6-dibenzoyloxy-4a-hydroxy-4,7,11b-trimethyl-5,6,6a,7,11,11a-hexahydro-1H-naphtho[2,1-f][1]benzofuran-4-carboxylic acid	10531102	Click to see CC1C2C(CC3=C1C=CO3)C4(CC=CC(C4(C(C2OC(=O)C5=CC=CC=C5)OC(=O)C6=CC=CC=C6)O)(C)C(=O)O)C	570.60	unknown	via CMAUP database
(4S,4aS,5R,6R,6aS,7R,11aS,11bR)-6-acetyloxy-5-benzoyloxy-4a-hydroxy-4,7,11b-trimethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-4-carboxylic acid	11375664	Click to see	510.60	unknown	via CMAUP database
[(3S,4aS,6aS,7R,11aS,11bR)-4a-hydroxy-4,4,7,11b-tetramethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-3-yl] benzoate	54597566	Click to see CC1C2CCC3(C(C(CCC3(C2CC4=C1C=CO4)C)OC(=O)C5=CC=CC=C5)(C)C)O	422.60	unknown	via CMAUP database
[(4aR,5R,6aS,7R,11aS,11bR)-4a-hydroxy-4,4,7,11b-tetramethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-5-yl] (E)-3-phenylprop-2-enoate	54597568	Click to see	448.60	unknown	via CMAUP database
[(4aR,5R,6aS,7R,11aS,11bR)-4a-hydroxy-4,4,7,11b-tetramethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-5-yl] benzoate	54597567	Click to see	422.60	unknown	via CMAUP database
[(4aR,5R,6R,6aS,7R,11aS,11bR)-4a,5-dihydroxy-4,4,7,11b-tetramethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-6-yl] acetate	54597503	Click to see	376.50	unknown	via CMAUP database
[(4aR,5R,6R,6aS,7R,11aS,11bR)-4a,5-dihydroxy-4,4,7,11b-tetramethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-6-yl] benzoate	11750983	Click to see	438.60	unknown	via CMAUP database
[(4aR,5R,6R,6aS,7R,11aS,11bR)-4a,6-dihydroxy-4,4,7,11b-tetramethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-5-yl] acetate	54597504	Click to see	376.50	unknown	via CMAUP database
[(4aR,5R,6R,6aS,7R,11aS,11bR)-4a,6-dihydroxy-4,4,7,11b-tetramethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f]benzofuran-5-yl] (E)-3-phenylprop-2-enoate	6479669	Click to see	464.60	unknown	via CMAUP database
[(4aR,6S,6aS,7R,11aS,11bR)-4a-hydroxy-4,4,7,11b-tetramethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-6-yl] acetate	54597502	Click to see	360.50	unknown	via CMAUP database
[(4R,4aS,5R,6aR,11aS,11bR)-5-benzoyloxy-4a-hydroxy-4,11b-dimethyl-7-methylidene-1,2,3,5,6,6a,11,11a-octahydronaphtho[2,1-f][1]benzofuran-4-yl]methyl benzoate	10951647	Click to see	540.60	unknown	via CMAUP database
[(4R,4aS,5R,6aS,7R,11aS,11bR)-4a,5-dihydroxy-4,7,11b-trimethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-4-yl]methyl benzoate	53388797	Click to see CC1C2CC(C3(C(CCCC3(C2CC4=C1C=CO4)C)(C)COC(=O)C5=CC=CC=C5)O)O	438.60	unknown	via CMAUP database
[(4S,4aS,5R,6R,6aS,7R,11aS,11bR)-4-formyl-4a,6-dihydroxy-4,7,11b-trimethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-5-yl] benzoate	53388795	Click to see	452.50	unknown	via CMAUP database
Isovouacapenol A	636673	Click to see CC1(CCCC2(C1(C(CC3C2CC4=C(C3=C)C=CO4)OC(=O)C5=CC=CC=C5)O)C)C	420.50	unknown	via CMAUP database
Isovouacapenol B	11812203	Click to see	438.60	unknown	via CMAUP database
Isovouacapenol C	3009285	Click to see CC1C2C(CC3=C1C=CO3)C4(CCCC(C4(C(C2O)OC(=O)C5=CC=CC=C5)O)(C)C)C	438.60	unknown	via CMAUP database
methyl (3S,4aS,5R,6R,6aR,7S,11aS,11bR)-5-acetyloxy-3-benzoyloxy-4a,6-dihydroxy-4,4,11b-trimethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-7-carboxylate	53388938	Click to see	540.60	unknown	via CMAUP database
Pulcherrin M	54597569	Click to see CC1C2CC(C3(C(C2CC4=C1C=CO4)(CCCC3(C)C(=O)O)C)O)OC(=O)C5=CC=CC=C5	452.50	unknown	via CMAUP database
Vouacapen-5alpha-ol	73354918	Click to see CC1C2CCC3(C(CCCC3(C2CC4=C1C=CO4)C)(C)C)O	302.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Acyclic diterpenoids
Rel-(7S,11S,E)-3,7,11,15-tetramethylhexadec-2-en-1-ol	40467768	Click to see CC(C)CCCC(C)CCCC(C)CCCC(=CCO)C	296.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids
Geraniol	637566	Click to see CC(=CCCC(=CCO)C)C	154.25	unknown	https://doi.org/10.1016/0305-1978(84)90011-5
Linalool, (-)-	443158	Click to see CC(=CCCC(C)(C=C)O)C	154.25	unknown	via CMAUP database
Myrcene	31253	Click to see	136.23	unknown	https://doi.org/10.1016/0305-1978(89)90100-2 https://doi.org/10.1016/0031-9422(95)00492-P https://doi.org/10.1135/CCCC19661113
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Aromatic monoterpenoids
Carvacrol	10364	Click to see CC1=C(C=C(C=C1)C(C)C)O	150.22	unknown	https://doi.org/10.1016/0305-1978(84)90011-5
Carvacryl methyl ether	80790	Click to see	164.24	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
P-Cymene	7463	Click to see	134.22	unknown	https://doi.org/10.1080/10412905.1999.9701152 https://doi.org/10.1016/0031-9422(95)00492-P https://doi.org/10.1135/CCCC19661113
Thymol	6989	Click to see	150.22	unknown	https://doi.org/10.1016/0305-1978(84)90011-5
Thymyl methyl ether	14104	Click to see	164.24	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids
(-)-1(6),10-Pacifigorgiadiene	131752221	Click to see	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
(-)-alpha-Pinene	440968	Click to see CC1=CCC2CC1C2(C)C	136.23	unknown	https://doi.org/10.1135/CCCC19661113
(-)-beta-Pinene	440967	Click to see	136.23	unknown	https://doi.org/10.1016/0031-9422(95)00492-P https://doi.org/10.1135/CCCC19661113
(-)-Camphene	440966	Click to see	136.23	unknown	https://doi.org/10.1016/0031-9422(95)00492-P https://doi.org/10.1135/CCCC19661113
(-)-Myrtenyl acetate	12635160	Click to see	194.27	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
(-)-Pacifigorgiol	73828281	Click to see CC1CCC2C(CCC2(C1C=C(C)C)O)C	222.37	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8 https://doi.org/10.1016/S0031-9422(00)81590-3
(+-)-alpha-Pinene	6654	Click to see	136.23	unknown	https://doi.org/10.1016/0305-1978(89)90100-2 https://doi.org/10.1080/10412905.1999.9701152 https://doi.org/10.1016/0305-1978(84)90011-5 https://doi.org/10.1016/0031-9422(95)00492-P
(+-)-Myrtenol	10582	Click to see	152.23	unknown	https://doi.org/10.1016/0305-1978(84)90011-5 https://doi.org/10.1016/0305-1978(89)90100-2 https://doi.org/10.1016/0031-9422(95)00492-P https://doi.org/10.1080/10412905.1999.9701152
(+)-1(9),10-Pacifigorgiadiene	131752220	Click to see	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
(+)-alpha-Fenchene	12309838	Click to see CC1(C2CCC1C(=C)C2)C	136.23	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
(+)-Isoborneol	6973640	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	https://doi.org/10.1016/S0021-9673(01)93725-2 https://doi.org/10.1016/0305-1978(89)90100-2
(+)-Sabinene	10887971	Click to see	136.23	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
(1R,4S,5R,7aS)-1,5-dimethyl-4-(2-methylprop-1-enyl)-2,4,5,6,7,7a-hexahydro-1H-indene	101131093	Click to see	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
(1R,4S,5R)-1,5-dimethyl-4-(2-methylprop-1-enyl)-2,3,4,5,6,7-hexahydro-1H-indene	101131094	Click to see CC1CCC2=C(C1C=C(C)C)CCC2C	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
(1S,3aR,4R,5S,7aR)-1,5-dimethyl-4-(2-methylprop-1-enyl)-1,2,3,4,5,6,7,7a-octahydroinden-3a-ol	162903927	Click to see	222.37	unknown	https://doi.org/10.1016/S0031-9422(00)81590-3
(1S,3aS,4R,5S,7aR)-1,5-dimethyl-4-(2-methylprop-1-enyl)-1,2,3,4,5,6,7,7a-octahydroinden-3a-ol	21717775	Click to see	222.37	unknown	https://doi.org/10.1016/S0031-9422(00)81590-3
(3R)-4-methylidene-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-ol	42626428	Click to see	152.23	unknown	via CMAUP database
(4S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one	23308299	Click to see CC1(C2CCC1(C(=O)C2)C)C	152.23	unknown	via CMAUP database
(6,6-Dimethylbicyclo(3.1.1)hept-2-en-2-yl)methyl acetate	61262	Click to see	194.27	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
(E)-3-[(3aR,4S,7R,7aR)-3,7-dimethyl-3a,4,5,6,7,7a-hexahydro-1H-inden-4-yl]-2-methylprop-2-enoic acid	162951452	Click to see	234.33	unknown	https://doi.org/10.1055/S-2002-32909
(R)-Fenchone; L-(-)-Fenchone; L-Fenchone; l-Fenchone	2794921	Click to see	152.23	unknown	via CMAUP database
[(1R,5R)-6,6-dimethyl-2-bicyclo[3.1.1]hept-2-enyl]methanol	6973635	Click to see	152.23	unknown	via CMAUP database
[(1S,2R,4S)-5,5-dimethyl-6-methylidene-2-bicyclo[2.2.1]heptanyl] acetate	13969119	Click to see	194.27	unknown	https://doi.org/10.1002/(SICI)1099-1026(199709/10)12:5<359::AID-FFJ660>3.0.CO;2-G
[(1S,2S,4S)-5,5-dimethyl-6-methylidene-2-bicyclo[2.2.1]heptanyl] acetate	163008521	Click to see	194.27	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
[(3R,4S)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] 3-methylbutanoate	24832090	Click to see CC(C)CC(=O)OC1CC2CCC1(C2(C)C)C	238.37	unknown	via CMAUP database
3-(3,7-dimethyl-3a,4,5,6,7,7a-hexahydro-1H-inden-4-yl)-2-methylprop-2-enoic acid	162951451	Click to see	234.33	unknown	https://doi.org/10.1055/S-2002-32909
7,7-Dimethyl-2-methylenenorbornane	10887972	Click to see	136.23	unknown	https://doi.org/10.1135/CCCC19661113
Acetic acid 1,7,7-trimethyl-bicyclo(2.2.1)hept-2-yl ester	6448	Click to see	196.29	unknown	https://doi.org/10.1016/0031-9422(95)00492-P https://doi.org/10.1002/(SICI)1099-1026(199709/10)12:5<359::AID-FFJ660>3.0.CO;2-G https://doi.org/10.1016/S0021-9673(01)93725-2 https://doi.org/10.1016/0378-8741(88)90123-7 https://doi.org/10.1055/S-2006-959991 https://doi.org/10.1016/0305-1978(89)90100-2 https://doi.org/10.1080/10412905.2000.9699524 https://doi.org/10.1080/10412905.1999.9701152 https://doi.org/10.1135/CCCC19661113 https://doi.org/10.1016/0305-1978(84)90011-5 https://doi.org/10.1055/S-2006-957392
alpha-Fenchene	28930	Click to see CC1(C2CCC1C(=C)C2)C	136.23	unknown	https://doi.org/10.1080/10412905.1999.9701152 https://doi.org/10.1016/0031-9422(95)00492-P
alpha-Pinene, (+)-	82227	Click to see	136.23	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
Beta-Pinene	14896	Click to see	136.23	unknown	https://doi.org/10.1016/0305-1978(89)90100-2 https://doi.org/10.1080/10412905.1999.9701152 https://doi.org/10.1016/0031-9422(95)00492-P https://doi.org/10.1016/S0021-9673(01)93725-2
Borneol	64685	Click to see	154.25	unknown	https://doi.org/10.1055/S-2006-959991 https://doi.org/10.1002/(SICI)1099-1026(199709/10)12:5<359::AID-FFJ660>3.0.CO;2-G https://doi.org/10.1055/S-2006-957392 https://doi.org/10.1016/0305-1978(89)90100-2 https://doi.org/10.1080/10412905.2000.9699524 https://doi.org/10.1080/10412905.1999.9701152 https://doi.org/10.1016/0378-8741(88)90123-7 https://doi.org/10.1016/S0021-9673(01)93725-2 https://doi.org/10.1080/0972060X.2011.10643905 https://doi.org/10.1016/0305-1978(84)90011-5 https://doi.org/10.1135/CCCC19661113
Bornyl acetate, (-)-	93009	Click to see	196.29	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
Bornyl formate	518472	Click to see	182.26	unknown	https://doi.org/10.1135/CCCC19661113
Camphene	6616	Click to see	136.23	unknown	https://doi.org/10.1016/0305-1978(89)90100-2 https://doi.org/10.1080/10412905.1999.9701152 https://doi.org/10.1016/0305-1978(84)90011-5 https://doi.org/10.1016/0031-9422(95)00492-P https://doi.org/10.1135/CCCC19661113 https://doi.org/10.1002/(SICI)1099-1026(199709/10)12:5<359::AID-FFJ660>3.0.CO;2-G https://doi.org/10.1016/S0021-9673(01)93725-2
CID 44630107	44630107	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	https://doi.org/10.1016/0305-1978(89)90100-2 https://doi.org/10.1080/10412905.1999.9701152 https://doi.org/10.1016/S0021-9673(01)93725-2 https://doi.org/10.1080/0972060X.2011.10643905 https://doi.org/10.1016/0305-1978(84)90011-5
Myrtenol, (-)-	88301	Click to see CC1(C2CC=C(C1C2)CO)C	152.23	unknown	https://doi.org/10.1016/0305-1978(89)90100-2 https://doi.org/10.1016/0031-9422(95)00492-P
Nojigiku acetate	185812	Click to see	194.27	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
Npc126240	44630108	Click to see	196.29	unknown	via CMAUP database
Pacifigorgiol	91747130	Click to see	222.37	unknown	via CMAUP database
rel-(-)-(1R,3aR,4S,5R,7aS)-Octahydro-1,5-dimethyl-4-(2-methyl-1-propen-1-yl)-3aH-inden-3a-ol	162903928	Click to see	222.37	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
Sabinene	18818	Click to see	136.23	unknown	https://doi.org/10.1016/0031-9422(95)00492-P https://doi.org/10.1016/0305-1978(89)90100-2
Tricyclene	79035	Click to see	136.23	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Iridoids and derivatives
[(1S,6S,7aS)-4-(acetyloxymethyl)-1-(3-methylbutanoyloxy)spiro[6,7a-dihydro-1H-cyclopenta[c]pyran-7,2'-oxirane]-6-yl] 3-methylbutanoate	3033955	Click to see	422.50	unknown	via CMAUP database
[(4aR,7R,7aS)-6-acetyloxy-1-(3-methylbutanoyloxy)spiro[4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-7,2'-oxirane]-4-yl]methyl 3-methylbutanoate	137796089	Click to see CC(C)CC(=O)OCC1=COC(C2C1CC(C23CO3)OC(=O)C)OC(=O)CC(C)C	424.50	unknown	https://doi.org/10.1055/S-2006-961613 https://doi.org/10.1016/0031-9422(95)91889-9 https://doi.org/10.1021/NP50036A004 https://doi.org/10.3109/13880208709060916 https://doi.org/10.1007/BF02332944 https://doi.org/10.1007/BF00233361 https://doi.org/10.1021/NP50012A004 https://doi.org/10.1016/0378-8741(88)90123-7 https://doi.org/10.1002/(SICI)1099-1565(200005/06)11:3<179::AID-PCA515>3.0.CO;2-5 https://doi.org/10.1002/PCA.2800050605
[4-(acetyloxymethyl)-1-(3-methylbut-2-enoyloxy)spiro[6,7a-dihydro-1H-cyclopenta[c]pyran-7,2'-oxirane]-6-yl] 3-methylbutanoate	163045254	Click to see	420.50	unknown	https://doi.org/10.1016/0378-8741(88)90123-7
Butanoic acid, 3-methyl-, 4-((acetyloxy)methyl)-7-formyl-1,3,4,7a-tetrahydro-1-hydroxycyclopenta(c)pyran-4-yl ester	51226	Click to see CC(C)CC(=O)OC1(COC(C2C1=CC=C2C=O)O)COC(=O)C	338.40	unknown	https://doi.org/10.1016/0378-8741(88)90123-7
Butanoic acid, 3-methyl-, 4-[(acetyloxy)methyl]-1,4a,5,6,7,7a-hexahydro-7-methylcyclopenta[c]pyran-1-yl ester, [1S-(1alpha,4aalpha,7alpha,7aalpha)]-	101681746	Click to see CC1CCC2C1C(OC=C2COC(=O)C)OC(=O)CC(C)C	310.40	unknown	https://doi.org/10.1016/0031-9422(95)91889-9
Diavaltrate	101656903	Click to see	380.40	unknown	https://doi.org/10.1016/0378-8741(88)90123-7
Didrovaltrate	65689	Click to see CC(C)CC(=O)OCC1=COC(C2C1CC(C23CO3)OC(=O)C)OC(=O)CC(C)C	424.50	unknown	https://doi.org/10.1007/S10600-009-9344-8 https://doi.org/10.1055/S-2006-961613 https://doi.org/10.1016/0031-9422(95)91889-9 https://doi.org/10.1021/NP50036A004 https://doi.org/10.3109/13880208709060916 https://doi.org/10.1007/BF02332944 https://doi.org/10.1021/NP50012A004 https://doi.org/10.1007/BF00233361 https://doi.org/10.1016/0378-8741(88)90123-7 https://doi.org/10.1002/(SICI)1099-1565(200005/06)11:3<179::AID-PCA515>3.0.CO;2-5 https://doi.org/10.1002/PCA.2800050605
Dihydrovaltrate	5218261	Click to see CC(C)CC(=O)OCC1=COC(C2C1CC(C23CO3)OC(=O)C)OC(=O)CC(C)C	424.50	unknown	https://doi.org/10.1007/S10600-009-9344-8
Homodidrovaltratum	12958352	Click to see	438.50	unknown	https://doi.org/10.1016/0378-8741(88)90123-7
Isovaltrate	92275	Click to see	422.50	unknown	https://doi.org/10.1055/S-2006-961613 https://doi.org/10.1016/0031-9422(95)91889-9 https://doi.org/10.1021/NP50036A004 https://doi.org/10.3109/13880208709060916 https://doi.org/10.1055/S-2006-957392 https://doi.org/10.1016/0031-9422(74)80247-5 https://doi.org/10.1021/NP50012A004 https://doi.org/10.1007/BF00233361 https://doi.org/10.1016/0378-8741(88)90123-7 https://doi.org/10.1002/(SICI)1099-1565(200005/06)11:3<179::AID-PCA515>3.0.CO;2-5 https://doi.org/10.1002/PCA.2800050605
Valdiate	129715809	Click to see	310.40	unknown	https://doi.org/10.1016/0031-9422(95)91889-9
Valechlorine	71522011	Click to see	458.90	unknown	https://doi.org/10.1016/0378-8741(88)90123-7
Valepotriate	537344	Click to see	422.50	unknown	https://doi.org/10.1021/NP0203335 https://doi.org/10.1007/S10600-009-9344-8
Valtrate	442436	Click to see	422.50	unknown	https://doi.org/10.1055/S-2006-961613 https://doi.org/10.1007/S10600-009-9344-8 https://doi.org/10.1016/0378-8741(88)90123-7 https://doi.org/10.1021/NP0203335 https://doi.org/10.1055/S-2006-957392 https://doi.org/10.1007/BF00574813 https://doi.org/10.1007/BF00233361 https://doi.org/10.3109/13880208709060916 https://doi.org/10.1007/BF02332944 https://doi.org/10.1002/PCA.2800050605 https://doi.org/10.1021/NP50036A004 https://doi.org/10.1021/NP50012A004 https://doi.org/10.1002/(SICI)1099-1565(200005/06)11:3<179::AID-PCA515>3.0.CO;2-5 https://doi.org/10.1016/0031-9422(95)91889-9
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Menthane monoterpenoids
(-)-beta-Phellandrene	443161	Click to see CC(C)C1CCC(=C)C=C1	136.23	unknown	https://doi.org/10.1135/CCCC19661113
(+)-Limonene	440917	Click to see	136.23	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
4-Terpineol, (+/-)-	11230	Click to see CC1=CCC(CC1)(C(C)C)O	154.25	unknown	https://doi.org/10.1080/10412905.1999.9701152
alpha-PHELLANDRENE	7460	Click to see CC1=CCC(C=C1)C(C)C	136.23	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
alpha-PHELLANDRENE, (-)-	442482	Click to see	136.23	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
Alpha-Terpinene	7462	Click to see	136.23	unknown	https://doi.org/10.1016/0031-9422(95)00492-P https://doi.org/10.1016/0305-1978(89)90100-2
Alpha-Terpineol	17100	Click to see	154.25	unknown	https://doi.org/10.1016/0305-1978(89)90100-2 https://doi.org/10.1080/10412905.1999.9701152 https://doi.org/10.1016/0305-1978(84)90011-5 https://doi.org/10.1016/S0021-9673(01)93725-2
Beta-Phellandrene	11142	Click to see CC(C)C1CCC(=C)C=C1	136.23	unknown	https://doi.org/10.1016/0031-9422(95)00492-P https://doi.org/10.1016/0305-1978(89)90100-2
Carvone, (+-)-	7439	Click to see	150.22	unknown	https://doi.org/10.1016/0305-1978(84)90011-5
Carvone, (+)-	16724	Click to see CC1=CCC(CC1=O)C(=C)C	150.22	unknown	https://doi.org/10.1016/0305-1978(84)90011-5
d-beta-Phellandrene	442484	Click to see	136.23	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
Limonene, (-)-	439250	Click to see	136.23	unknown	https://doi.org/10.1135/CCCC19661113
Limonene, (+/-)-	22311	Click to see CC1=CCC(CC1)C(=C)C	136.23	unknown	https://doi.org/10.1016/0305-1978(89)90100-2 https://doi.org/10.1080/10412905.1999.9701152 https://doi.org/10.1016/0031-9422(95)00492-P https://doi.org/10.1016/S0021-9673(01)93725-2
Perillyl acetate	61780	Click to see CC(=C)C1CCC(=CC1)COC(=O)C	194.27	unknown	via CMAUP database
Terpinolene	11463	Click to see	136.23	unknown	https://doi.org/10.1016/0031-9422(95)00492-P https://doi.org/10.1016/0305-1978(89)90100-2 https://doi.org/10.1016/S0021-9673(01)93725-2 https://doi.org/10.1135/CCCC19661113
> Lipids and lipid-like molecules / Prenol lipids / Retinoids
[(E,7R)-3,7-dimethyl-9-[(1S,6S)-2,2,6-trimethylcyclohexyl]non-2-enyl] acetate	162905171	Click to see	336.60	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
(+)-beta-Caryophyllene	20831623	Click to see	204.35	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
(1R,2R)-1-methyl-4-propan-2-ylidene-1,2-bis(prop-1-en-2-yl)cyclohexane	162961670	Click to see CC(=C1CCC(C(C1)C(=C)C)(C)C(=C)C)C	218.38	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
(1R,2R)-4-methyl-1-[(2R)-6-methylhept-5-en-2-yl]cyclohex-3-ene-1,2-diol	101380093	Click to see CC1=CC(C(CC1)(C(C)CCC=C(C)C)O)O	238.37	unknown	https://doi.org/10.1016/S0031-9422(00)89759-9 https://doi.org/10.1248/CPB.54.123
(1R,2S,6S,7S,8R)-1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]dec-3-ene	50919054	Click to see CC1=CCC2C3C1C2(CCC3C(C)C)C	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
(1S,4R,4aR,8aS)-4,7-dimethyl-1-propan-2-yl-1,2,3,4,4a,5,6,8a-octahydronaphthalene	101677425	Click to see	206.37	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
(1S,4R,6R,10R)-4,12,12-trimethyl-9-methylidene-5-oxatricyclo[8.2.0.04,6]dodecane	42433495	Click to see	220.35	unknown	via CMAUP database
(1S,4R,6S,10R)-4,12,12-trimethyl-9-methylidene-5-oxatricyclo[8.2.0.04,6]dodecane	7067459	Click to see	220.35	unknown	via CMAUP database
(1Z,4E)-2,6,6,9-tetramethylcycloundeca-1,4,8-triene	45115091	Click to see CC1=CCC(C=CCC(=CCC1)C)(C)C	204.35	unknown	via CMAUP database
(3S,4R)-4-ethenyl-4-methyl-1-propan-2-yl-3-prop-1-en-2-ylcyclohexene	12004383	Click to see	204.35	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
(3S,4S)-4-ethenyl-4-methyl-1-propan-2-yl-3-prop-1-en-2-ylcyclohexene	163033310	Click to see	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
(4aS,7S,8aR)-4a,8a-dimethyl-7-propan-2-yl-3,4,5,6,7,8-hexahydro-2H-naphthalen-1-one	163017276	Click to see CC(C)C1CCC2(CCCC(=O)C2(C1)C)C	222.37	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
(E)-2-epi-beta-caryophyllene	6429274	Click to see	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
(E)-3-[(1aS,3aR,4R,7S,7aS)-1a,4-dimethyl-3,3a,4,5,6,7-hexahydro-2H-indeno[1,7a-b]oxiren-7-yl]-2-methylprop-2-enal	44482330	Click to see CC1CCC(C23C1CCC2(O3)C)C=C(C)C=O	234.33	unknown	https://doi.org/10.1021/NP9003382
(E)-3-[(1aS,3aR,4R,7S,7aS)-1a,4-dimethyl-3,3a,4,5,6,7-hexahydro-2H-indeno[1,7a-b]oxiren-7-yl]-2-methylprop-2-enoic acid	95790459	Click to see	250.33	unknown	https://doi.org/10.1055/S-2002-32909
(E)-3-[(1R,4S,7R,7aR)-1-acetyloxy-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl]-2-methylprop-2-enoic acid	6537490	Click to see CC1CCC(C2=C(CC(C12)OC(=O)C)C)C=C(C)C(=O)O	292.40	unknown	https://doi.org/10.1002/JLAC.19576030117
(E)-3-[(1S,4R,7S,7aS)-1-hydroxy-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl]-2-methylprop-2-enoic acid	92973822	Click to see CC1CCC(C2=C(CC(C12)O)C)C=C(C)C(=O)O	250.33	unknown	https://doi.org/10.1016/S0944-7113(98)80032-9 https://doi.org/10.1002/(SICI)1099-1565(200005/06)11:3<179::AID-PCA515>3.0.CO;2-5 https://doi.org/10.1016/S0031-9422(00)94517-5 https://doi.org/10.1016/J.NEUROPHARM.2008.06.013 https://doi.org/10.1055/S-2008-1081343 https://doi.org/10.1055/S-2006-957392
(E)-3-[(4R,7S)-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl]-2-methylprop-2-enoic acid	42608162	Click to see	234.33	unknown	via CMAUP database
(E)-3-[(4S,7R,7aR)-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl]-2-methylprop-2-en-1-ol	102500932	Click to see CC1CCC(C2=C(CCC12)C)C=C(C)CO	220.35	unknown	https://doi.org/10.1016/S0031-9422(00)81590-3 https://doi.org/10.1016/0031-9422(95)00492-P
(R)-beta-bisabolene	68128	Click to see CC1=CCC(CC1)C(=C)CCC=C(C)C	204.35	unknown	https://doi.org/10.1016/0305-1978(89)90100-2 https://doi.org/10.1016/0305-1978(84)90011-5
(Z)-2-methyl-3-(1,3,7-trimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl)prop-2-enoic acid	5315158	Click to see	248.36	unknown	https://doi.org/10.1135/CCCC19650553
(Z)-3-[(4R,7S)-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl]-2-methylprop-2-en-1-ol	91747207	Click to see	220.35	unknown	via CMAUP database
(Z)-3-[(4S,7R,7aR)-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl]-2-methylprop-2-enoic acid	5281538	Click to see CC1CCC(C2=C(CCC12)C)C=C(C)C(=O)O	234.33	unknown	https://doi.org/10.1016/J.CHROMA.2007.12.011 https://doi.org/10.1002/(SICI)1099-1026(199709/10)12:5<359::AID-FFJ660>3.0.CO;2-G https://doi.org/10.1016/J.PHYMED.2009.10.020 https://doi.org/10.1021/NP9003382 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1894911/ https://doi.org/10.1055/S-0032-1315240 https://doi.org/10.1055/S-2006-957392 https://doi.org/10.1111/J.1742-4658.2012.08692.X https://doi.org/10.1016/S0031-9422(00)94517-5 https://doi.org/10.1016/J.NEUROPHARM.2008.06.013 https://doi.org/10.1515/ZNC-1997-11-1222 https://doi.org/10.1016/0378-8741(88)90123-7 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3092575/ https://doi.org/10.1055/S-2008-1081343 https://doi.org/10.1002/(SICI)1099-1565(200005/06)11:3<179::AID-PCA515>3.0.CO;2-5 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3196969/ https://doi.org/10.1016/J.JCHROMB.2011.05.005 https://doi.org/10.1016/S0944-7113(98)80032-9
(Z)-alpha-Bisabolene	5352653	Click to see	204.35	unknown	https://doi.org/10.1016/0305-1978(84)90011-5
[(1R,6R)-6-hydroxy-3-methyl-6-[(2R)-6-methylhept-5-en-2-yl]cyclohex-2-en-1-yl] acetate	163066041	Click to see	280.40	unknown	https://doi.org/10.1016/S0031-9422(00)89759-9
[(E)-3-[(1aS,3aR,4R,7S,7aS)-1a,4-dimethyl-3,3a,4,5,6,7-hexahydro-2H-indeno[1,7a-b]oxiren-7-yl]-2-methylprop-2-enyl] acetate	44482331	Click to see	278.40	unknown	https://doi.org/10.1021/NP9003382
[(E)-3-[(4S,7R,7aR)-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl]-2-methylprop-2-enyl] acetate	163090255	Click to see	262.40	unknown	https://doi.org/10.1016/S0031-9422(00)81590-3 https://doi.org/10.1016/0031-9422(95)00492-P
[(Z)-3-[(4S,7R,7aR)-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl]-2-methylprop-2-enyl] acetate	163090254	Click to see	262.40	unknown	https://doi.org/10.1016/S0031-9422(00)81590-3
[3-(1a,4-dimethyl-3,3a,4,5,6,7-hexahydro-2H-indeno[1,7a-b]oxiren-7-yl)-2-methylprop-2-enyl] acetate	75034363	Click to see	278.40	unknown	https://doi.org/10.1021/NP9003382
[3-(3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl)-2-methylprop-2-enyl] acetate	76685779	Click to see	262.40	unknown	https://doi.org/10.1016/S0031-9422(00)81590-3 https://doi.org/10.1016/0031-9422(95)00492-P
[6-Hydroxy-3-methyl-6-(6-methylhept-5-en-2-yl)cyclohex-2-en-1-yl] acetate	163066040	Click to see	280.40	unknown	https://doi.org/10.1016/S0031-9422(00)89759-9
1-Isopropyl-4,7-dimethyl-1,2,4a,5,8,8a-hexahydronaphthalene	521380	Click to see	204.35	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
1-Methyl-4-propan-2-ylidene-1,2-bis(prop-1-en-2-yl)cyclohexane	162961669	Click to see CC(=C1CCC(C(C1)C(=C)C)(C)C(=C)C)C	218.38	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
1,4,8-Cycloundecatriene, 2,6,6,9-tetramethyl-, (1E,4E,8E)-	23204	Click to see CC1=CCC(C=CCC(=CCC1)C)(C)C	204.35	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
1H-Indene, 2,4,5,6,7,7a-hexahydro-3,7-dimethyl-4-(2-methyl-1-propenyl)-, (4S,7R,7aR)-	76685772	Click to see CC1CCC(C2=C(CCC12)C)C=C(C)C	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
3-(1a,4-dimethyl-3,3a,4,5,6,7-hexahydro-2H-indeno[1,7a-b]oxiren-7-yl)-2-methylprop-2-enal	75034362	Click to see CC1CCC(C23C1CCC2(O3)C)C=C(C)C=O	234.33	unknown	https://doi.org/10.1021/NP9003382
3-(1a,4-dimethyl-3,3a,4,5,6,7-hexahydro-2H-indeno[1,7a-b]oxiren-7-yl)-2-methylprop-2-enoic acid	162893678	Click to see	250.33	unknown	https://doi.org/10.1055/S-2002-32909
3-(3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl)-2-methylprop-2-en-1-ol	76685777	Click to see	220.35	unknown	https://doi.org/10.1016/S0031-9422(00)81590-3 https://doi.org/10.1016/0031-9422(95)00492-P
3-(3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl)-2-methylprop-2-enal	73830931	Click to see	218.33	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
4-Methyl-1-(6-methylhept-5-en-2-yl)cyclohex-3-ene-1,2-diol	163097224	Click to see CC1=CC(C(CC1)(C(C)CCC=C(C)C)O)O	238.37	unknown	https://doi.org/10.1016/S0031-9422(00)89759-9 https://doi.org/10.1248/CPB.54.123
4,11,11-Trimethyl-8-methylenebicyclo(7.2.0)undec-4-ene	26318	Click to see	204.35	unknown	https://doi.org/10.1016/0031-9422(95)00492-P https://doi.org/10.1016/S0031-9422(01)00018-8
4,12,12-Trimethyl-9-methylene-5-oxatricyclo(8.2.0.04,6)dodecane	14350	Click to see	220.35	unknown	https://doi.org/10.1016/S0031-9422(00)89759-9
4,7-Dimethyl-1-propan-2-yl-1,2,3,4,4a,5,6,8a-octahydronaphthalene	73721077	Click to see	206.37	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
4a-(hydroxymethyl)-8a-methyl-7-propan-2-yl-3,4,5,6,7,8-hexahydro-2H-naphthalen-1-one	75144766	Click to see CC(C)C1CCC2(CCCC(=O)C2(C1)C)CO	238.37	unknown	https://doi.org/10.1248/CPB.43.169
4a,8a-dimethyl-7-propan-2-yl-3,4,5,6,7,8-hexahydro-2H-naphthalen-1-one	527498	Click to see CC(C)C1CCC2(CCCC(=O)C2(C1)C)C	222.37	unknown	https://doi.org/10.1016/0031-9422(95)00492-P https://doi.org/10.2478/V10136-009-0002-Z
7-Hydroxycadalene	608115	Click to see	214.30	unknown	via CMAUP database
Acetoxyvalerenic Acid	91864465	Click to see	292.40	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3196969/ https://doi.org/10.1021/NP9003382 https://doi.org/10.1016/S0944-7113(98)80032-9 https://doi.org/10.1002/(SICI)1099-1565(200005/06)11:3<179::AID-PCA515>3.0.CO;2-5 https://doi.org/10.1016/S0031-9422(00)94517-5 https://doi.org/10.1055/S-2008-1081343 https://doi.org/10.1055/S-2006-957392
Acetoxyvalerensre	133672	Click to see CC1CCC(C2=C(CC(C12)OC(=O)C)C)C=C(C)C(=O)O	292.40	unknown	https://doi.org/10.1002/JLAC.19576030117
Acetylvalerenolic acid	6439585	Click to see	292.40	unknown	https://doi.org/10.1002/JLAC.19576030117
alpha-Bisabolene, (E)-	5315468	Click to see	204.35	unknown	https://doi.org/10.1016/0305-1978(84)90011-5
alpha-Bisabolol	10586	Click to see CC1=CCC(CC1)C(C)(CCC=C(C)C)O	222.37	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
alpha-Cadinol	10398656	Click to see CC1=CC2C(CCC(C2CC1)(C)O)C(C)C	222.37	unknown	via CMAUP database
alpha-Elemene	80048	Click to see CC(C)C1=CC(=C(C)C)CCC1(C)C=C	204.35	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
alpha-Ylangene	101607926	Click to see	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
Beta-Bisabolene	10104370	Click to see CC1=CCC(CC1)C(=C)CCC=C(C)C	204.35	unknown	https://doi.org/10.1016/0305-1978(89)90100-2 https://doi.org/10.1135/CCCC19661113 https://doi.org/10.1016/0305-1978(84)90011-5
beta-Cadinene	10657	Click to see	204.35	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
beta-Cubebene	93081	Click to see	204.35	unknown	https://doi.org/10.1016/0305-1978(89)90100-2
Bicyclo(7.2.0)undec-4-ene, 4,11,11-trimethyl-8-methylene-, (1S,4E,9R)-	5452236	Click to see	204.35	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
Bisabolol	1549992	Click to see CC1=CCC(CC1)C(C)(CCC=C(C)C)O	222.37	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
Cadina-1(10),4-diene	10223	Click to see CC1=CC2C(CCC(=C2CC1)C)C(C)C	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
Cadinane	9548708	Click to see	208.38	unknown	via CMAUP database
Caryophyllene	5281515	Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C	204.35	unknown	https://doi.org/10.1016/0305-1978(89)90100-2 https://doi.org/10.1080/10412905.1999.9701152 https://doi.org/10.1016/0305-1978(84)90011-5 https://doi.org/10.1135/CCCC19661113 https://doi.org/10.1016/S0031-9422(01)00018-8 https://doi.org/10.1016/S0021-9673(01)93725-2
Caryophyllene oxide	1742210	Click to see	220.35	unknown	https://doi.org/10.2478/V10136-009-0002-Z https://doi.org/10.1016/0031-9422(92)83718-E
Caryophyllene,alpha + beta mixt.	5354499	Click to see	204.35	unknown	https://doi.org/10.2478/V10136-009-0002-Z https://doi.org/10.1135/CCCC19661113 https://doi.org/10.1016/0305-1978(84)90011-5
cis-beta-Guaiene	15560253	Click to see	204.35	unknown	https://doi.org/10.1080/10412905.1999.9701152
Copaene	19725	Click to see CC1=CCC2C3C1C2(CCC3C(C)C)C	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
Copaene	12303902	Click to see CC1=CCC2C3C1C2(CCC3C(C)C)C	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
Curcumene	92139	Click to see	202.33	unknown	https://doi.org/10.1080/10412905.1999.9701152 https://doi.org/10.1135/CCCC19661113
Cyclohexene, 4-ethenyl-4-methyl-3-(1-methylethenyl)-1-(1-methylethyl)-, (3R-trans)-	89316	Click to see	204.35	unknown	https://doi.org/10.1016/0031-9422(95)00492-P https://doi.org/10.1016/S0031-9422(01)00018-8
Cyclohexene, 6-ethenyl-6-methyl-1-(1-methylethyl)-3-(1-methylethylidene)-, (S)-	521885	Click to see CC(C)C1=CC(=C(C)C)CCC1(C)C=C	204.35	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
delta-Cadinene	441005	Click to see	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
Elixene	94254	Click to see	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
gamma-Cadinene	6432404	Click to see	204.35	unknown	https://doi.org/10.1135/CCCC19661113
Gamma-elemene, (-)-	12309452	Click to see	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
Humulene	5281520	Click to see	204.35	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
Hydroxyvalerenic acid	6537505	Click to see	250.33	unknown	https://doi.org/10.1002/JLAC.19576030117
I2-Ionone	638014	Click to see	192.30	unknown	https://doi.org/10.1016/0305-1978(89)90100-2 https://doi.org/10.1016/0031-9422(95)00492-P https://doi.org/10.1080/10412905.1999.9701152
Isolongifolene	11127402	Click to see CC1(CCC=C2C13CCC(C3)C2(C)C)C	204.35	unknown	via CMAUP database
Kanokonol	46173905	Click to see	238.37	unknown	https://doi.org/10.1248/CPB.43.169
Nardin	4229818	Click to see	234.33	unknown	https://doi.org/10.1002/JLAC.19576030117 https://doi.org/10.1016/0031-9422(95)00492-P https://doi.org/10.1111/J.1742-4658.2012.08692.X https://doi.org/10.1055/S-2008-1081343 https://doi.org/10.1016/J.JCHROMB.2011.05.005 https://doi.org/10.1016/J.PHYMED.2009.10.020 https://doi.org/10.1055/S-0032-1315240 https://doi.org/10.1016/J.CHROMA.2007.12.011 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3092575/ https://doi.org/10.1021/NP9003382
S-Curcumene	3083834	Click to see	202.33	unknown	via CMAUP database
Valeranone	171455	Click to see	222.37	unknown	https://doi.org/10.1080/10412905.1999.9701152 https://doi.org/10.1016/0305-1978(89)90100-2 https://doi.org/10.1080/0972060X.2011.10643905 https://doi.org/10.1055/S-2006-959991 https://doi.org/10.1016/S0031-9422(00)84048-0 https://doi.org/10.1055/S-2006-957392 https://doi.org/10.1135/CCCC19622638 https://doi.org/10.1080/10412905.2000.9699524 https://doi.org/10.1007/BF02193381
Valerena-4,7(11)-diene	58067884	Click to see CC1CCC(C2=C(CCC12)C)C=C(C)C	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
Valerenal	6440942	Click to see	218.33	unknown	https://doi.org/10.1016/0031-9422(95)00492-P https://doi.org/10.1080/0972060X.2011.10643905 https://doi.org/10.1055/S-2006-959991 https://doi.org/10.1016/S0031-9422(00)84048-0 https://doi.org/10.1016/J.NEUROPHARM.2008.06.013 https://doi.org/10.1055/S-2006-957392 https://doi.org/10.1016/0378-8741(88)90123-7 https://doi.org/10.1080/10412905.2000.9699524 https://doi.org/10.1016/S0031-9422(00)94517-5
Valerenic acid	6440940	Click to see CC1CCC(C2=C(CCC12)C)C=C(C)C(=O)O	234.33	unknown	https://doi.org/10.1002/JLAC.19576030117 https://doi.org/10.1016/J.CHROMA.2007.12.011 https://doi.org/10.1002/(SICI)1099-1026(199709/10)12:5<359::AID-FFJ660>3.0.CO;2-G https://doi.org/10.1021/NP9003382 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1894911/ https://doi.org/10.1055/S-2006-957392 https://doi.org/10.1055/S-2002-32909 https://doi.org/10.1016/S0031-9422(00)94517-5 https://doi.org/10.1016/J.NEUROPHARM.2008.06.013 https://doi.org/10.1515/ZNC-1997-11-1222 https://doi.org/10.1016/0378-8741(88)90123-7 https://doi.org/10.2478/V10136-009-0002-Z https://doi.org/10.1055/S-2008-1081343 https://doi.org/10.1002/(SICI)1099-1565(200005/06)11:3<179::AID-PCA515>3.0.CO;2-5 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3196969/ https://doi.org/10.1016/S0944-7113(98)80032-9 https://doi.org/10.1016/0031-9422(95)00492-P
Valerenol	91699505	Click to see CC1CCC(C2=C(CCC12)C)C=C(C)CO	220.35	unknown	https://doi.org/10.1016/J.NEUROPHARM.2008.06.013
Valerenolic acid	6439586	Click to see CC1CCC(C2=C(CC(C12)O)C)C=C(C)C(=O)O	250.33	unknown	https://doi.org/10.1135/CCCC19650553
Ylangene	20055075	Click to see	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Aristolane sesquiterpenoids
1H-Cyclopropa(a)naphthalene, 1a,2,3,5,6,7,7a,7b-octahydro-1,1,7,7a-tetramethyl-, (1aR-(1aalpha,7alpha,7aalpha,7balpha))-	15560278	Click to see CC1CCC=C2C1(C3C(C3(C)C)CC2)C	204.35	unknown	https://doi.org/10.2478/V10136-009-0002-Z
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Aromadendrane sesquiterpenoids / 5,10-cycloaromadendrane sesquiterpenoids
(-)-alpha-Gurjunene	15560276	Click to see	204.35	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
(+)-Ledol	11074994	Click to see	222.37	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
(1aR,4aR,7S,7aS,7bR)-1,1,7-trimethyl-4-methylidene-1a,2,3,4a,5,6,7a,7b-octahydrocyclopropa[h]azulen-7-ol	13854258	Click to see	220.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
(1aS,4aS,7S,7aR,7bS)-1,1,7-trimethyl-4-methylidene-1a,2,3,4a,5,6,7a,7b-octahydrocyclopropa[h]azulen-7-ol	97032059	Click to see	220.35	unknown	https://doi.org/10.1080/10412905.2000.9699524 https://doi.org/10.1080/10412905.1999.9701152
(1R,2R,3S,5S,8S,10S)-4,4,8,10-tetramethyl-9-oxatetracyclo[6.4.0.02,10.03,5]dodecane	162908583	Click to see CC1(C2C1C3C4CCC3(OC4(CC2)C)C)C	220.35	unknown	https://doi.org/10.1002/CBDV.201000247
(7aR)-1,1,7-trimethyl-4-methylidene-1a,2,3,4a,5,6,7a,7b-octahydrocyclopropa[h]azulen-7-ol	5321422	Click to see	220.35	unknown	https://doi.org/10.1080/10412905.2000.9699524 https://doi.org/10.1080/10412905.1999.9701152 https://doi.org/10.1016/S0031-9422(01)00018-8
1,1,4,7-Tetramethyl-1a,2,3,5,6,7,7a,7b-octahydrocyclopropa[e]azulene	89532	Click to see	204.35	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
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	204.35	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
1H-Cycloprop(e)azulene, decahydro-1,1,7-trimethyl-4-methylene-, (1aR-(1aalpha,4abeta,7alpha,7abeta,7balpha))-	91354	Click to see	204.35	unknown	https://doi.org/10.1016/0031-9422(95)00492-P https://doi.org/10.1016/S0031-9422(01)00018-8
1H-Cycloprop[e]azulen-4-ol, decahydro-1,1,4,7-tetramethyl-, [1ar-(1aalpha,4alpha,4abeta,7alpha,7abeta,7balpha)]-	6432561	Click to see	222.37	unknown	via CMAUP database
Alloaromadendren	91746537	Click to see	204.35	unknown	https://doi.org/10.1007/BF02293248 https://doi.org/10.1016/0305-1978(89)90100-2
Alloaromadendrene	10899740	Click to see	204.35	unknown	https://doi.org/10.1135/CCCC19661113 https://doi.org/10.1016/S0031-9422(01)00018-8
Alloaromadendrene	12305247	Click to see CC1CCC2C1C3C(C3(C)C)CCC2=C	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
beta-Diploalbicene	177445	Click to see	204.35	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
beta-Spathulenol	522266	Click to see	220.35	unknown	https://doi.org/10.1002/CBDV.201000247 https://doi.org/10.1016/S0031-9422(01)00018-8
Npc239037	101716	Click to see	222.37	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
Spathulenol	92231	Click to see CC1(C2C1C3C(CCC3(C)O)C(=C)CC2)C	220.35	unknown	https://doi.org/10.1002/CBDV.201000247
Spathulenol, (-)-	13854255	Click to see	220.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
Viridiflorene	10910653	Click to see CC1CCC2=C(CCC3C(C12)C3(C)C)C	204.35	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Bicyclogermacrane and isolepidozane sesquiterpenoids
(+)-Bicyclogermacrene	5315347	Click to see	204.35	unknown	https://doi.org/10.1080/10412905.1999.9701152
(1S,2E,10R)-3,7,11,11-tetramethylbicyclo[8.1.0]undeca-2,6-diene	44583886	Click to see	204.35	unknown	https://doi.org/10.1080/10412905.1999.9701152
Bicyclogermacrene	13894537	Click to see CC1=CCCC(=CC2C(C2(C)C)CC1)C	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
CID 522276	522276	Click to see	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
trans-Bicyclogermacradiene	11820258	Click to see	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Elemane sesquiterpenoids
(-)-Bicycloelemene	101973934	Click to see	204.35	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
2-(4-Ethenyl-4-methyl-3-(prop-1-en-2-yl)cyclohexyl)propan-2-ol	547972	Click to see	222.37	unknown	https://doi.org/10.1016/0305-1978(89)90100-2 https://doi.org/10.1016/0378-8741(88)90123-7
a Bicycloelemene	76419358	Click to see	204.35	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
Beta-Elemene	6918391	Click to see	204.35	unknown	https://doi.org/10.1016/0031-9422(95)00492-P https://doi.org/10.1016/S0031-9422(01)00018-8 https://doi.org/10.1135/CCCC19661113
Cyclohexane, 1-ethenyl-1-methyl-2,4-bis(1-methylethenyl)-, (1R,2R,4S)-	9859094	Click to see	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
Cyclohexane, 1-ethenyl-1-methyl-2,4-bis(1-methylethenyl)-, (1R,2R,4S)-rel-	10583	Click to see	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8 https://doi.org/10.1016/0031-9422(95)00492-P
Elemol	92138	Click to see	222.37	unknown	https://doi.org/10.1080/0972060X.2011.10643905 https://doi.org/10.1016/0305-1978(89)90100-2 https://doi.org/10.1016/0378-8741(88)90123-7
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eremophilane, 8,9-secoeremophilane and furoeremophilane sesquiterpenoids
(+)-Eremophilene	6431897	Click to see CC1CCC=C2C1(CC(CC2)C(=C)C)C	204.35	unknown	https://doi.org/10.1135/CCCC19661113
1,2,3,4,6,7,8,8a-Octahydro-alpha,alpha,8,8a-tetramethyl-2-naphthalenemethanol	146808	Click to see	222.37	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
2-[(2R,8aR)-8,8a-dimethyl-2,3,4,6,7,8-hexahydro-1H-naphthalen-2-yl]propan-2-ol	5315163	Click to see CC1CCC=C2C1(CC(CC2)C(C)(C)O)C	222.37	unknown	https://doi.org/10.1055/S-2006-959991 https://doi.org/10.1055/S-2006-957392 https://doi.org/10.1002/(SICI)1099-1026(199709/10)12:5<359::AID-FFJ660>3.0.CO;2-G
Eremophilene	12309744	Click to see CC1CCC=C2C1(CC(CC2)C(=C)C)C	204.35	unknown	via CMAUP database
Valerianol	9859337	Click to see CC1CCC=C2C1(CC(CC2)C(C)(C)O)C	222.37	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8 https://doi.org/10.1016/S0040-4039(00)90572-0
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eudesmane, isoeudesmane or cycloeudesmane sesquiterpenoids
(-)-beta-Selinene	28237	Click to see CC(=C)C1CCC2(CCCC(=C)C2C1)C	204.35	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
7-Isopropenyl-4a-methyl-1-methylenedecahydronaphthalene	519361	Click to see	204.35	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
Beta-Eudesmol	91457	Click to see	222.37	unknown	https://doi.org/10.1002/(SICI)1099-1026(199709/10)12:5<359::AID-FFJ660>3.0.CO;2-G
Beta-Selinene	442393	Click to see	204.35	unknown	via CMAUP database
Maalialcohol	10944069	Click to see CC1(C2C1C3C(CCCC3(C)O)(CC2)C)C	222.37	unknown	https://doi.org/10.1016/0031-9422(92)83718-E
Npc289143	521242	Click to see	204.35	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Germacrane sesquiterpenoids
1,5-Dimethyl-8-(propan-2-ylidene)cyclodeca-1,5-diene	177602	Click to see	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
1,6-Cyclodecadiene, 1-methyl-5-methylene-8-(1-methylethyl)-	91104	Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
Germacrene B	5281519	Click to see CC1=CCCC(=CCC(=C(C)C)CC1)C	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
Germacrene D	5317570	Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C	204.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Guaianes
(1R,3aR,8aS)-1-methyl-4-methylidene-7-propan-2-yl-2,3,3a,5,6,8a-hexahydroazulen-1-ol	102113807	Click to see	220.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
(1S,3aS,8aS)-1-methyl-4-methylidene-7-propan-2-yl-2,3,3a,5,6,8a-hexahydroazulen-1-ol	163187688	Click to see	220.35	unknown	https://doi.org/10.1002/CBDV.201000247
1-Methyl-4-methylidene-7-propan-2-yl-2,3,3a,5,6,8a-hexahydroazulen-1-ol	73102746	Click to see	220.35	unknown	https://doi.org/10.1002/CBDV.201000247 https://doi.org/10.1016/S0031-9422(01)00018-8
Alismol	137357	Click to see	220.35	unknown	https://doi.org/10.1016/S0031-9422(01)00018-8
Guaiazulene	3515	Click to see	198.30	unknown	https://doi.org/10.1135/CCCC19661113
Orientalol C	162930471	Click to see	236.35	unknown	https://doi.org/10.1002/CBDV.201000247
Teucladiol	16046185	Click to see CC(C)C1CCC(=C)C2CCC(C2C1O)(C)O	238.37	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides
[(1S,4aS,6S,7R,7aS)-6-hydroxy-7-(hydroxymethyl)-4-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-yl] 3-methylbutanoate	163012924	Click to see	462.50	unknown	https://doi.org/10.1016/0031-9422(92)83718-E
[6-Hydroxy-7-(hydroxymethyl)-4-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-yl] 3-methylbutanoate	4490287	Click to see	462.50	unknown	https://doi.org/10.1016/0031-9422(92)83718-E https://doi.org/10.1016/0031-9422(95)00022-Y
6-Hydroxy-7-(hydroxymethyl)-4-({[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}methyl)-1H,4ah,5H,6H,7H,7ah-cyclopenta[c]pyran-1-yl 3-methylbutanoate	75144768	Click to see CC(C)CC(=O)OC1C2C(CC(C2CO)O)C(=CO1)COC3C(C(C(C(O3)COC4C(C(C(C(O4)CO)O)O)O)O)O)O	624.60	unknown	https://doi.org/10.1016/0031-9422(92)83718-E
beta-D-Glucopyranoside, ((1S,4aS,6S,7R,7aS)-1,4a,5,6,7,7a-hexahydro-6,7-dihydroxy-7-(hydroxymethyl)-1-(3-methyl-1-oxobutoxy)cyclopenta(c)pyran-4-yl)methyl	46173906	Click to see	478.50	unknown	https://doi.org/10.1016/0378-8741(88)90123-7
Kanokoside D	46173908	Click to see	624.60	unknown	https://doi.org/10.1016/0378-8741(88)90123-7 https://doi.org/10.1016/0031-9422(92)83718-E https://doi.org/10.1016/S0031-9422(00)89759-9
Patrinoside	162135	Click to see CC(C)CC(=O)OC1C2C(CC(C2CO)O)C(=CO1)COC3C(C(C(C(O3)CO)O)O)O	462.50	unknown	https://doi.org/10.1016/0378-8741(88)90123-7 https://doi.org/10.1016/0031-9422(92)83718-E https://doi.org/10.1016/0031-9422(95)00022-Y https://doi.org/10.1016/S0031-9422(00)89759-9
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Iridoid O-glycosides
[(6S)-6,7-dihydroxy-7-methyl-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-yl]methyl 3-methylbutanoate	24893667	Click to see CC(C)CC(=O)OCC1=COC(C2C1CC(C2(C)O)O)OC3C(C(C(C(O3)CO)O)O)O	462.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones
(4aR,5S,8aR,9aR)-3,4a,5-trimethyl-4,5,6,7,8,8a,9,9a-octahydrobenzo[f][1]benzofuran-2-one	10933426	Click to see	234.33	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Sesquiterpene lactones / Germacranolides and derivatives
(1S,2R,12S,14R)-5,9,14-trimethyl-3,13-dioxatetracyclo[8.4.0.02,6.012,14]tetradeca-5,9-dien-4-one	11770726	Click to see CC1=C2CC3C(C2C4C(=C(C(=O)O4)C)CC1)(O3)C	246.30	unknown	https://doi.org/10.1016/0031-9422(92)83718-E https://doi.org/10.1248/CPB.43.169 https://doi.org/10.1016/0031-9422(95)00700-8
> Lipids and lipid-like molecules / Prenol lipids / Tetraterpenoids / Carotenoids / Xanthophylls
Canthaxanthin	5281227	Click to see	564.80	unknown	https://doi.org/10.2478/V10136-009-0002-Z
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
(+)-Ursolic Acid	64945	Click to see	456.70	unknown	https://doi.org/10.2478/V10136-009-0002-Z
beta-Sitosteryl stearate	13828710	Click to see	681.20	unknown	https://doi.org/10.1135/CCCC19591884
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Hydroxysteroids
(3S,4S,4aS,5R,6aS,7R,11aS,11bR)-3,5-dibenzoyloxy-4a-hydroxy-4,7,11b-trimethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-4-carboxylic acid	53388796	Click to see CC1C2CC(C3(C(C2CC4=C1C=CO4)(CCC(C3(C)C(=O)O)OC(=O)C5=CC=CC=C5)C)O)OC(=O)C6=CC=CC=C6	572.60	unknown	via CMAUP database
(3S,4S,4aS,5R,6R,6aS,7R,11aS,11bR)-3-acetyloxy-5,6-dibenzoyloxy-4a-hydroxy-4,7,11b-trimethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-4-carboxylic acid	10627788	Click to see	630.70	unknown	via CMAUP database
(3S,4S,4aS,5R,6R,6aS,7R,11aS,11bR)-5,6-dibenzoyloxy-3,4a-dihydroxy-4,7,11b-trimethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-4-carboxylic acid	10698605	Click to see	588.60	unknown	via CMAUP database
(3S,4S,4aS,5R,6R,6aS,7R,11aS,11bR)-6-acetyloxy-3,5-dibenzoyloxy-4a-hydroxy-4,7,11b-trimethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-4-carboxylic acid	11157932	Click to see	630.70	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Hydroxysteroids / 7-hydroxysteroids / 7-alpha-hydroxysteroids
methyl (3S,4S,4aS,5R,6R,6aR,7S,11aS,11bR)-6-acetyloxy-4-(acetyloxymethyl)-3-benzoyloxy-4a,5-dihydroxy-4,11b-dimethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-7-carboxylate	53388939	Click to see	598.60	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Pregnane steroids / Gluco/mineralocorticoids, progestogins and derivatives
(17-acetyl-12-acetyloxy-3,8,14-trihydroxy-10,13-dimethyl-2,3,4,7,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-11-yl) acetate	85252331	Click to see	464.50	unknown	https://doi.org/10.1055/S-2006-959991 https://doi.org/10.1055/S-2006-957392 https://doi.org/10.1002/(SICI)1099-1026(199709/10)12:5<359::AID-FFJ660>3.0.CO;2-G
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal glycosides
[(2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-[[(1R,3R,5S,8S,9S,10S,13S,14S,16S,17R)-3-hydroxy-17-[(2S,3S)-3-hydroxy-6-methylhept-5-en-2-yl]-10,13-dimethyl-1-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-16-yl]oxy]oxan-2-yl]methyl acetate	163010719	Click to see	785.00	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
(-)-beta-Sitosterol	222284	Click to see	414.70	unknown	https://doi.org/10.1016/0031-9422(95)00700-8
(3S,8R,9R,10R,13R,14R,17R)-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	11870456	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	414.70	unknown	via CMAUP database
17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol	86821	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	414.70	unknown	https://doi.org/10.2478/V10136-009-0002-Z https://doi.org/10.1016/0031-9422(95)00700-8
beta-Sitosterol 3-O-beta-D-galactopyranoside	296119	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C	576.80	unknown	https://doi.org/10.1055/S-2005-864179
Glucoclionasterol	12309067	Click to see	576.80	unknown	https://doi.org/10.1055/S-2005-864179
Stigmast-5-en-3-ol	22012	Click to see	414.70	unknown	https://doi.org/10.1016/0031-9422(95)00700-8
> 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/10.1055/S-2006-959538
D-Alanine	71080	Click to see	89.09	unknown	https://doi.org/10.1055/S-2006-959538
L-Alanine	5950	Click to see	89.09	unknown	https://doi.org/10.1055/S-2006-959538
> 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
L-Arginine	6322	Click to see	174.20	unknown	https://doi.org/10.1055/S-2006-959538
L-Glutamine	5961	Click to see	146.14	unknown	https://doi.org/10.1055/S-2006-959538
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Asparagine and derivatives
(-)-Asparagine	6267	Click to see	132.12	unknown	https://doi.org/10.1055/S-2006-959538
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Aspartic acid and derivatives
D-Aspartic Acid	83887	Click to see	133.10	unknown	https://doi.org/10.1055/S-2006-959538
L-Aspartic Acid	5960	Click to see	133.10	unknown	https://doi.org/10.1055/S-2006-959538
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Glutamic acid and derivatives
L-Glutamic Acid	33032	Click to see	147.13	unknown	https://doi.org/10.1055/S-2006-959538
> 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/10.1055/S-2006-959538
> 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/10.1055/S-2006-959538
> 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	165.19	unknown	https://doi.org/10.1055/S-2006-959538
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Serine and derivatives
L-Serine	5951	Click to see	105.09	unknown	https://doi.org/10.1055/S-2006-959538
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Valine and derivatives
(2-Amino-3-methylbutanoyl) 2-amino-3-methylbutanoate	5315167	Click to see	216.28	unknown	via CMAUP database
Valine	6287	Click to see CC(C)C(C(=O)O)N	117.15	unknown	https://doi.org/10.1055/S-2006-959538
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Amino acids and derivatives / Gamma amino acids and derivatives
Gamma-Aminobutyric Acid	119	Click to see C(CC(=O)O)CN	103.12	unknown	https://doi.org/10.1055/S-2006-959538
> Organic acids and derivatives / Carboxylic acids and derivatives / Carboxylic acid derivatives / Carboxylic acid esters
(12,12-Dimethyl-8-oxo-4-bicyclo[9.1.0]dodeca-4,9-dienyl)methyl acetate	73129351	Click to see CC(=O)OCC1=CCCC(=O)C=CC2C(C2(C)C)CC1	276.40	unknown	https://doi.org/10.1055/S-2005-916210
(4,12,12-Trimethyl-8-oxo-2-bicyclo[9.1.0]dodeca-4,9-dienyl) acetate	73035535	Click to see	276.40	unknown	https://doi.org/10.1248/CPB.54.123
[(1R,2R,4Z,9Z,11S)-4,12,12-trimethyl-8-oxo-2-bicyclo[9.1.0]dodeca-4,9-dienyl] acetate	11630488	Click to see	276.40	unknown	https://doi.org/10.1248/CPB.54.123
Kissoone C	11859077	Click to see	276.40	unknown	https://doi.org/10.1055/S-2005-916210
> Organic acids and derivatives / Carboxylic acids and derivatives / Pentacarboxylic acids and derivatives
[(1S,4aR,6S,7R,7aS)-6-acetyloxy-4a,7-dihydroxy-1-(3-methylbutanoyloxy)-7-(3-methylbutanoyloxymethyl)-1,5,6,7a-tetrahydrocyclopenta[c]pyran-4-yl]methyl (2R)-3-methyl-2-(3-methylbutanoyloxy)butanoate	124523227	Click to see	642.70	unknown	https://doi.org/10.1021/NP9003382
[(1S,4aR,6S,7R,7aS)-6-acetyloxy-7-(acetyloxymethyl)-4a,7-dihydroxy-1-(3-methylbutanoyloxy)-1,5,6,7a-tetrahydrocyclopenta[c]pyran-4-yl]methyl (2R)-3-methyl-2-(3-methylbutanoyloxy)butanoate	154496811	Click to see	600.70	unknown	https://doi.org/10.1021/NP9003382
Jatamanvaltrate B	42640646	Click to see	642.70	unknown	https://doi.org/10.1021/NP9003382
Jatamanvaltrate C	42640468	Click to see	600.70	unknown	https://doi.org/10.1021/NP9003382
> Organic acids and derivatives / Carboxylic acids and derivatives / Tetracarboxylic acids and derivatives
[(1S,4aR,6S,7R,7aS)-6-acetyloxy-4a-hydroxy-1-(3-methylbutanoyloxy)spiro[1,5,6,7a-tetrahydrocyclopenta[c]pyran-7,2'-oxirane]-4-yl]methyl (2R)-3-methyl-2-(3-methylbutanoyloxy)butanoate	124504844	Click to see	540.60	unknown	https://doi.org/10.1021/NP9003382
[(1S,4aR,6S,7R,7aS)-6-acetyloxy-7-(chloromethyl)-4a,7-dihydroxy-1-(3-methylbutanoyloxy)-1,5,6,7a-tetrahydrocyclopenta[c]pyran-4-yl]methyl (2R)-3-methyl-2-(3-methylbutanoyloxy)butanoate	163013485	Click to see CC(C)CC(=O)OC1C2C(CC(C2(CCl)O)OC(=O)C)(C(=CO1)COC(=O)C(C(C)C)OC(=O)CC(C)C)O	577.10	unknown	https://doi.org/10.1021/NP9003382
[(1S,4aR,6S,7R,7aS)-6-acetyloxy-7-(chloromethyl)-4a,7-dihydroxy-1-(3-methylbutanoyloxy)-1,5,6,7a-tetrahydrocyclopenta[c]pyran-4-yl]methyl (2S)-3-methyl-2-(3-methylbutanoyloxy)butanoate	163013486	Click to see	577.10	unknown	https://doi.org/10.1021/NP9003382
[(4aR,7R,7aS)-6-acetyloxy-4a-hydroxy-1-(3-methylbutanoyloxy)spiro[1,5,6,7a-tetrahydrocyclopenta[c]pyran-7,2'-oxirane]-4-yl]methyl 3-methyl-2-(3-methylbutanoyloxy)butanoate	137705477	Click to see CC(C)CC(=O)OC1C2C(CC(C23CO3)OC(=O)C)(C(=CO1)COC(=O)C(C(C)C)OC(=O)CC(C)C)O	540.60	unknown	https://doi.org/10.1021/NP9003382
[(4aR,7S,7aS)-6-acetyloxy-7-(chloromethyl)-4a,7-dihydroxy-1-(3-methylbutanoyloxy)-1,5,6,7a-tetrahydrocyclopenta[c]pyran-4-yl]methyl 3-methyl-2-(3-methylbutanoyloxy)butanoate	137706555	Click to see	577.10	unknown	https://doi.org/10.1021/NP9003382
[(7R,7aS)-4-(acetyloxymethyl)-1-(3-methylbutanoyloxy)spiro[6,7a-dihydro-1H-cyclopenta[c]pyran-7,2'-oxirane]-6-yl] 3-acetyloxy-3-methylbutanoate	137706187	Click to see	480.50	unknown	https://doi.org/10.1021/NP50012A004 https://doi.org/10.1021/NP50036A004 https://doi.org/10.1002/(SICI)1099-1565(200005/06)11:3<179::AID-PCA515>3.0.CO;2-5 https://doi.org/10.1007/BF02332944
[1-Acetyloxy-4a-hydroxy-6-(3-methylbutanoyloxy)spiro[1,5,6,7a-tetrahydrocyclopenta[c]pyran-7,2'-oxirane]-4-yl]methyl 3-methyl-2-(3-methylbutanoyloxy)butanoate	5318683	Click to see	540.60	unknown	via CMAUP database
[4-(acetyloxymethyl)-7-hydroxy-1,6-bis(3-methylbutanoyloxy)-6,7a-dihydro-1H-cyclopenta[c]pyran-7-yl]methyl 3-methylbutanoate	75044760	Click to see CC(C)CC(=O)OCC1(C(C=C2C1C(OC=C2COC(=O)C)OC(=O)CC(C)C)OC(=O)CC(C)C)O	524.60	unknown	https://doi.org/10.1248/CPB.54.123
[6-Acetyloxy-7-(chloromethyl)-4a,7-dihydroxy-1-(3-methylbutanoyloxy)-1,5,6,7a-tetrahydrocyclopenta[c]pyran-4-yl]methyl 3-methyl-2-(3-methylbutanoyloxy)butanoate	75034361	Click to see	577.10	unknown	https://doi.org/10.1021/NP9003382
4-[(Acetyloxy)methyl]-1-[(3-methylbutanoyl)oxy]-6,7a-dihydro-1H-spiro[cyclopenta[c]pyran-7,2'-oxiran]-6-yl 3-(acetyloxy)-3-methylbutanoate	22245467	Click to see CC(C)CC(=O)OC1C2C(=CC(C23CO3)OC(=O)CC(C)(C)OC(=O)C)C(=CO1)COC(=O)C	480.50	unknown	https://doi.org/10.1007/S10600-009-9344-8
Acevaltrate	65717	Click to see CC(C)CC(=O)OC1C2C(=CC(C23CO3)OC(=O)CC(C)(C)OC(=O)C)C(=CO1)COC(=O)C	480.50	unknown	https://doi.org/10.1007/S10600-009-9344-8 https://doi.org/10.1021/NP50036A004 https://doi.org/10.1007/BF02332944 https://doi.org/10.1021/NP50012A004 https://doi.org/10.1002/(SICI)1099-1565(200005/06)11:3<179::AID-PCA515>3.0.CO;2-5
Valtrate Hydrine B4	101380092	Click to see CC(C)CC(=O)OCC1(C(C=C2C1C(OC=C2COC(=O)C)OC(=O)CC(C)C)OC(=O)CC(C)C)O	524.60	unknown	https://doi.org/10.1248/CPB.54.123
Volvaltrate B	49831716	Click to see	577.10	unknown	https://doi.org/10.1021/NP100426J
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Primary alcohols
(2,5,5,8a-Tetramethyl-1,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)methanol	298071	Click to see	222.37	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
[(1S,4aR,8aS)-2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methanol	7478989	Click to see	222.37	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
1-Pentanol	6276	Click to see	88.15	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Tertiary alcohols
(1R,3R,6S,7S,8S,10R)-2,2,6,8-tetramethyltricyclo[5.3.1.03,8]undecane-3,10-diol	25082526	Click to see CC1CCC2(C(C3CC1C2(CC3O)C)(C)C)O	238.37	unknown	https://doi.org/10.1016/0031-9422(95)00022-Y
(1S,3R,7S,8S)-2,2,6,8-tetramethyltricyclo[5.3.1.03,8]undecan-3-ol	129317601	Click to see	222.37	unknown	https://doi.org/10.1016/0031-9422(95)00022-Y
(3-Hydroxy-2,2,6,8-tetramethyl-10-tricyclo[5.3.1.03,8]undecanyl) acetate	72815425	Click to see CC1CCC2(C(C3CC1C2(CC3OC(=O)C)C)(C)C)O	280.40	unknown	https://doi.org/10.1016/0031-9422(95)00022-Y
(6S,8S)-2,2,6,8-tetramethyltricyclo[5.3.1.03,8]undecan-3-ol	442384	Click to see	222.37	unknown	https://doi.org/10.1016/0031-9422(95)00022-Y
2,2,6,8-Tetramethyltricyclo[5.3.1.03,8]undecane-3,10-diol	72956616	Click to see CC1CCC2(C(C3CC1C2(CC3O)C)(C)C)O	238.37	unknown	https://doi.org/10.1016/0031-9422(95)00022-Y
8-Acetoxypatchouli alcohol	25082525	Click to see	280.40	unknown	https://doi.org/10.1016/0031-9422(95)00022-Y
Patchouli alcohol	10955174	Click to see	222.37	unknown	https://doi.org/10.1016/0031-9422(95)00022-Y
Patchoulialcohol	521903	Click to see CC1CCC2(C(C3CCC2(C1C3)C)(C)C)O	222.37	unknown	https://doi.org/10.1016/0031-9422(95)00022-Y
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[[(1S,2S,3R,5R,6R,8S,12S)-3-hydroxy-1,5,9,9-tetramethyl-10-oxatricyclo[6.2.2.02,6]dodecan-12-yl]oxy]oxane-3,4,5-triol	162906175	Click to see CC1CC(C2C1CC3C(CC2(OC3(C)C)C)OC4C(C(C(C(O4)CO)O)O)O)O	416.50	unknown	https://doi.org/10.1016/0031-9422(92)83718-E
[(1aS,1bS,5S,5aS,6S)-6-hydroxy-6-(hydroxymethyl)-2-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-1b,5,5a,6a-tetrahydro-1aH-oxireno[3,4]cyclopenta[1,3-d]pyran-5-yl] 3-methylbutanoate	76551304	Click to see	476.50	unknown	https://doi.org/10.1016/0031-9422(92)83718-E
[(1S,2S,4S,5S,6S,7S)-5-hydroxy-7-(3-methylbutanoyloxy)-10-[[(2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]-3,8-dioxatricyclo[4.4.0.02,4]dec-9-en-5-yl]methyl 3-methylbutanoate	163000368	Click to see CC(C)CC(=O)OCC1(C2C(C3C1O3)C(=COC2OC(=O)CC(C)C)COC4C(C(C(C(O4)COC5C(C(C(C(O5)CO)O)O)O)O)O)O)O	722.70	unknown	https://doi.org/10.1248/CPB.54.123
[5-Hydroxy-5-(hydroxymethyl)-10-[[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]-3,8-dioxatricyclo[4.4.0.02,4]dec-9-en-7-yl] 3-methylbutanoate	75144767	Click to see CC(C)CC(=O)OC1C2C(C3C(C2(CO)O)O3)C(=CO1)COC4C(C(C(C(O4)COC5C(C(C(C(O5)CO)O)O)O)O)O)O	638.60	unknown	https://doi.org/10.1016/0031-9422(92)83718-E
[5-Hydroxy-7-(3-methylbutanoyloxy)-10-[[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]-3,8-dioxatricyclo[4.4.0.02,4]dec-9-en-5-yl]methyl 3-methylbutanoate	73003397	Click to see	722.70	unknown	https://doi.org/10.1248/CPB.54.123
2-(Hydroxymethyl)-6-[(3-hydroxy-1,5,9,9-tetramethyl-10-oxatricyclo[6.2.2.02,6]dodecan-12-yl)oxy]oxane-3,4,5-triol	162906174	Click to see CC1CC(C2C1CC3C(CC2(OC3(C)C)C)OC4C(C(C(C(O4)CO)O)O)O)O	416.50	unknown	https://doi.org/10.1016/0031-9422(92)83718-E
Kanokoside A	10457683	Click to see	476.50	unknown	https://doi.org/10.1016/0378-8741(88)90123-7 https://doi.org/10.1016/0031-9422(92)83718-E https://doi.org/10.1016/0031-9422(95)00022-Y https://doi.org/10.1016/S0031-9422(00)89759-9
Kanokoside C	46173907	Click to see	638.60	unknown	https://doi.org/10.1016/0031-9422(92)83718-E https://doi.org/10.1016/S0031-9422(00)89759-9
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Alpha-hydrogen aldehydes
Pentanal	8063	Click to see	86.13	unknown	https://doi.org/10.1016/0305-1978(89)90100-2 https://doi.org/10.1016/0305-1978(84)90011-5
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Aryl-aldehydes
Baldrinal	159846	Click to see CC(=O)OCC1=COC=C2C1=CC=C2C=O	218.20	unknown	https://doi.org/10.1016/0378-8741(88)90123-7 https://doi.org/10.1002/(SICI)1099-1565(200005/06)11:3<179::AID-PCA515>3.0.CO;2-5
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Medium-chain aldehydes
Hexanal	6184	Click to see	100.16	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aryl ketones / Aryl alkyl ketones
2-Acetylpyrrole	14079	Click to see	109.13	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Benzoquinones / P-benzoquinones
2,6-Dimethoxyquinone	68262	Click to see COC1=CC(=O)C=C(C1=O)OC	168.15	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Cyclic ketones
(1R,2Z,7Z,11S)-8,12,12-trimethylbicyclo[9.1.0]dodeca-2,7-dien-4-one	163073508	Click to see	218.33	unknown	https://doi.org/10.1055/S-2005-916210
(1S,2Z,7E,11R)-8-(hydroxymethyl)-12,12-dimethylbicyclo[9.1.0]dodeca-2,7-dien-4-one	11859076	Click to see	234.33	unknown	https://doi.org/10.1055/S-2005-916210
8-(Hydroxymethyl)-12,12-dimethylbicyclo[9.1.0]dodeca-2,7-dien-4-one	73129350	Click to see	234.33	unknown	https://doi.org/10.1055/S-2005-916210
8,12,12-Trimethylbicyclo[9.1.0]dodeca-2,7-dien-4-one	74819442	Click to see	218.33	unknown	https://doi.org/10.1055/S-2005-916210
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones
1-[(3aS,4S,5S,7aR)-Octahydro-7a-methyl-5-(1-methylethyl)-1H-inden-4-yl]ethanone	102577163	Click to see CC(C)C1CCC2(CCCC2C1C(=O)C)C	222.37	unknown	https://doi.org/10.1016/S0031-9422(00)84048-0
Faurinone	131752034	Click to see	222.37	unknown	https://doi.org/10.1016/S0031-9422(00)84048-0
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Phenylketones / Alkyl-phenylketones
2-Pentanoylbenzoic acid	5315165	Click to see	206.24	unknown	via CMAUP database
> Organoheterocyclic compounds / Benzofurans / Dibenzofurans
alpha-Pyrufuran	159239	Click to see COC1=C(C(=C(C2=C1C3=CC=CC=C3O2)OC)OC)O	274.27	unknown	via CMAUP database
> Organoheterocyclic compounds / Benzopyrans / 1-benzopyrans / Xanthones / 4-prenylated xanthones
Gerontoxanthone C	14259059	Click to see	396.40	unknown	https://doi.org/10.1135/CCCC19591884
> Organoheterocyclic compounds / Diazanaphthalenes / Naphthyridines
1,3-Bis(1,8-naphthyridin-2-yl)propan-2-one	129664870	Click to see C1=CC2=C(N=C1)N=C(C=C2)CC(=O)CC3=NC4=C(C=CC=N4)C=C3	314.30	unknown	https://doi.org/10.1016/0378-8741(88)90123-7
> Organoheterocyclic compounds / Dioxepanes / 1,3-dioxepanes
(5-Acetyloxy-4,7-dihydroxy-11-methylidene-2,10-dioxatricyclo[5.3.1.04,8]undecan-9-yl) 3-methylbutanoate	75034360	Click to see CC(C)CC(=O)OC1C2C3(CC(C2(COC(C3=C)O1)O)OC(=O)C)O	356.40	unknown	https://doi.org/10.1021/NP9003382
[(1R,4S,5S,7R,8S,9S)-5-acetyloxy-4,7-dihydroxy-11-methylidene-2,10-dioxatricyclo[5.3.1.04,8]undecan-9-yl] 2-methylpropanoate	102418646	Click to see	342.34	unknown	https://doi.org/10.1021/NP9003382
[(1R,4S,5S,7R,8S,9S)-5-acetyloxy-4,7-dihydroxy-11-methylidene-2,10-dioxatricyclo[5.3.1.04,8]undecan-9-yl] 3-methylbutanoate	154497684	Click to see	356.40	unknown	https://doi.org/10.1021/NP9003382
> Organoheterocyclic compounds / Epoxides
(1S,4S,6S,9E,11R)-4,12,12-trimethyl-5-oxatricyclo[9.1.0.04,6]dodec-9-ene-9-carbaldehyde	162901166	Click to see	234.33	unknown	https://doi.org/10.1007/S10600-009-9344-8
4,12,12-Trimethyl-5-oxatricyclo[9.1.0.04,6]dodec-9-ene-9-carbaldehyde	72733386	Click to see	234.33	unknown	https://doi.org/10.1007/S10600-009-9344-8
> Organoheterocyclic compounds / Indoles and derivatives / Indoles / 2-phenylindoles
Ethyl 2-(2-bromo-5-(1-(4-(1,3-dioxoisoindolin-2-yl)butyl)-2-phenyl-1H-indole-6-car-bonyl)thiophen-3-yl)acetate	67502223	Click to see CCOC(=O)CC1=C(SC(=C1)C(=O)C2=CC3=C(C=C2)C=C(N3CCCCN4C(=O)C5=CC=CC=C5C4=O)C6=CC=CC=C6)Br	669.60	unknown	via CMAUP database
> Organoheterocyclic compounds / Lactones / Delta valerolactones
Volvalerelactone A	53363115	Click to see	266.33	unknown	https://doi.org/10.1021/OL200878W
> Organoheterocyclic compounds / Naphthofurans
[(1S,2R,4R,5S,7S,10R,11S,18R)-5-hydroxy-6,6,10,18-tetramethyl-3,14-dioxapentacyclo[9.7.0.02,4.05,10.013,17]octadeca-13(17),15-dien-7-yl] benzoate	53388940	Click to see CC1C2C(CC3=C1C=CO3)C4(CCC(C(C4(C5C2O5)O)(C)C)OC(=O)C6=CC=CC=C6)C	436.50	unknown	via CMAUP database
[(4aR,5R,6R,6aS,7R,10aR,11aS,11bR)-4a,6-dihydroxy-10a-methoxy-4,4,7,11b-tetramethyl-9-oxo-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-5-yl] benzoate	11386164	Click to see CC1C2C(CC3(C1=CC(=O)O3)OC)C4(CCCC(C4(C(C2O)OC(=O)C5=CC=CC=C5)O)(C)C)C	484.60	unknown	via CMAUP database
Neocaesalpin E	11450901	Click to see	348.50	unknown	via CMAUP database
Neocaesalpin G	11295185	Click to see	510.60	unknown	via CMAUP database
> Organoheterocyclic compounds / Oxanes
(1R,7S,8R,10R)-7,8-dimethyl-10-propan-2-yl-2-oxatricyclo[5.3.1.03,8]undecan-3-ol	101937315	Click to see CC(C)C1CC2(C3(CCCC2(OC1C3)O)C)C	238.37	unknown	https://doi.org/10.1055/S-2006-959991 https://doi.org/10.1007/BF02193381 https://doi.org/10.1055/S-2006-957392
(3R,7S,8R)-7,8-dimethyl-10-propan-2-yl-2-oxatricyclo[5.3.1.03,8]undecan-3-ol	6428530	Click to see	238.37	unknown	https://doi.org/10.1055/S-2006-959991 https://doi.org/10.1007/BF02193381 https://doi.org/10.1055/S-2006-957392
1-(1a,4-dimethyl-3,3a,4,5,6,7-hexahydro-2H-indeno[1,7a-b]oxiren-7-yl)propan-2-one	75034364	Click to see CC1CCC(C23C1CCC2(O3)C)CC(=O)C	222.32	unknown	https://doi.org/10.1021/NP9003382
1-[(1aS,3aR,4R,7S,7aR)-1a,4-dimethyl-3,3a,4,5,6,7-hexahydro-2H-indeno[1,7a-b]oxiren-7-yl]propan-2-one	44482332	Click to see	222.32	unknown	https://doi.org/10.1021/NP9003382
1,8-Cineole	2758	Click to see	154.25	unknown	via CMAUP database
> Organoheterocyclic compounds / Oxepanes
(1,5,6,9,9-Pentamethyl-10-oxatricyclo[6.2.2.02,6]dodecan-3-yl) acetate	162979971	Click to see	294.40	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
(12-Hydroxy-1,5,9,9-tetramethyl-10-oxatricyclo[6.2.2.02,6]dodecan-3-yl) acetate	162857839	Click to see	296.40	unknown	https://doi.org/10.1016/0031-9422(92)83718-E
(1R,2S,3R,5R,6R,8S)-1,5,9,9-tetramethyl-10-oxatricyclo[6.2.2.02,6]dodecan-3-ol	162844755	Click to see CC1CC(C2C1CC3CCC2(OC3(C)C)C)O	238.37	unknown	https://doi.org/10.1248/CPB.43.169
(1R,7aalpha)-1alpha-Ethoxy-3beta,7beta-epoxy-4-methylene-6alpha-acetoxy-7-(chloromethyl)octahydrocyclopenta[c]pyran-4aalpha-ol	49831712	Click to see CCOC1C2C3(CC(C2(OC(C3=C)O1)CCl)OC(=O)C)O	318.75	unknown	https://doi.org/10.1021/NP100426J
(1S,2R,5R,6R,8R)-1,5,6,9,9-pentamethyl-10-oxatricyclo[6.2.2.02,6]dodecane	162965536	Click to see	236.39	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
(1S,2R,5R,6R,8S,12S)-1,5,9,9-tetramethyl-10-oxatricyclo[6.2.2.02,6]dodecan-12-ol	12304810	Click to see	238.37	unknown	https://doi.org/10.1248/CPB.43.169
(1S,2S,3R,5R,6R,8R)-1,5,6,9,9-pentamethyl-10-oxatricyclo[6.2.2.02,6]dodecan-3-ol	162985954	Click to see	252.39	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
(1S,2S,3R,5R,6R,8S,12S)-1,5,9,9-Tetramethyl-10-oxatricyclo[6.2.2.02,6]dodecane-3,12-diol	12304812	Click to see CC1CC(C2C1CC3C(CC2(OC3(C)C)C)O)O	254.36	unknown	https://doi.org/10.1016/0031-9422(92)83718-E https://doi.org/10.1248/CPB.43.169 https://doi.org/10.1016/0378-8741(88)90123-7
(1S,3aS,4S,7S,8aS)-1,4,9,9-Tetramethyldecahydro-4,7-(epoxymethano)azulene	6451544	Click to see	222.37	unknown	https://doi.org/10.1080/10412905.1999.9701152 https://doi.org/10.1016/S0031-9422(00)89759-9 https://doi.org/10.1135/CCCC19661113 https://doi.org/10.1016/0378-8741(88)90123-7 https://doi.org/10.1002/(SICI)1099-1026(199709/10)12:5<359::AID-FFJ660>3.0.CO;2-G
(1S,3R,6R,8S)-1,5,9,9-tetramethyl-10-oxatricyclo[6.2.2.02,6]dodecane-3,12-diol	6325467	Click to see	254.36	unknown	via CMAUP database
(3-Hydroxy-1,5,9,9-tetramethyl-10-oxatricyclo[6.2.2.02,6]dodecan-12-yl) acetate	163072667	Click to see	296.40	unknown	https://doi.org/10.1016/0031-9422(92)83718-E https://doi.org/10.1016/0031-9422(95)00700-8
[(1R,2R,4S,5S,6R,8S)-1,5,9,9-tetramethyl-10-oxatricyclo[6.2.2.02,6]dodecan-4-yl] acetate	162867382	Click to see	280.40	unknown	https://doi.org/10.1002/CBDV.201000247
[(1R,2R,5R,6R,8S,9S)-1,5,9-trimethyl-10-oxatricyclo[6.2.2.02,6]dodecan-9-yl]methyl acetate	15786137	Click to see	280.40	unknown	https://doi.org/10.1002/CBDV.201000247
[(1R,2S,3R,5R,6R,8S)-1,5,9,9-tetramethyl-10-oxatricyclo[6.2.2.02,6]dodecan-3-yl] acetate	162929451	Click to see	280.40	unknown	https://doi.org/10.1016/0031-9422(92)83718-E https://doi.org/10.1248/CPB.43.169 https://doi.org/10.1016/0031-9422(95)00700-8
[(1R,3S,4S,6R,7S,8R)-3-(chloromethyl)-6-hydroxy-8-methoxy-10-methylidene-2,9-dioxatricyclo[4.3.1.03,7]decan-4-yl] acetate	49831714	Click to see CC(=O)OC1CC2(C3C1(OC(C2=C)OC3OC)CCl)O	304.72	unknown	https://doi.org/10.1021/NP100426J
[(1R,3S,4S,6R,7S,8R)-3-(chloromethyl)-6,8-dihydroxy-10-methylidene-2,9-dioxatricyclo[4.3.1.03,7]decan-4-yl] acetate	49831711	Click to see CC(=O)OC1CC2(C3C1(OC(C2=C)OC3O)CCl)O	290.69	unknown	https://doi.org/10.1021/NP100426J
[(1R,3S,4S,6R,7S,8S)-3-(chloromethyl)-6-hydroxy-8-methoxy-10-methylidene-2,9-dioxatricyclo[4.3.1.03,7]decan-4-yl] acetate	49831715	Click to see CC(=O)OC1CC2(C3C1(OC(C2=C)OC3OC)CCl)O	304.72	unknown	https://doi.org/10.1021/NP100426J
[(1R,3S,4S,6R,7S,8S)-3-(chloromethyl)-8-ethoxy-6-hydroxy-10-methylidene-2,9-dioxatricyclo[4.3.1.03,7]decan-4-yl] acetate	49831713	Click to see	318.75	unknown	https://doi.org/10.1021/NP100426J
[(1S,2R,5R,6R,8R,9S)-1,5,9-trimethyl-10-oxatricyclo[6.2.2.02,6]dodecan-9-yl]methyl acetate	162880350	Click to see	280.40	unknown	https://doi.org/10.1016/0031-9422(95)00700-8
[(1S,2R,5R,6R,8S,12S)-1,5,9,9-tetramethyl-10-oxatricyclo[6.2.2.02,6]dodecan-12-yl] acetate	101635456	Click to see	280.40	unknown	https://doi.org/10.1016/0031-9422(92)83718-E
[(1S,2S,3R,5R,6R,8R)-1,5,6,9,9-pentamethyl-10-oxatricyclo[6.2.2.02,6]dodecan-3-yl] acetate	162979972	Click to see	294.40	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
[(1S,2S,3R,5R,6R,8R)-1,5,9,9-tetramethyl-10-oxatricyclo[6.2.2.02,6]dodecan-3-yl] acetate	101635455	Click to see	280.40	unknown	https://doi.org/10.1080/10412905.2000.9699524
[(1S,2S,3R,5R,6R,8S,12S)-12-acetyloxy-1,5,9,9-tetramethyl-10-oxatricyclo[6.2.2.02,6]dodecan-3-yl] acetate	101620273	Click to see CC1CC(C2C1CC3C(CC2(OC3(C)C)C)OC(=O)C)OC(=O)C	338.40	unknown	https://doi.org/10.1016/0031-9422(92)83718-E https://doi.org/10.1248/CPB.43.169 https://doi.org/10.1016/0031-9422(95)00700-8
[(1S,2S,3R,5R,6R,8S,12S)-12-hydroxy-1,5,9,9-tetramethyl-10-oxatricyclo[6.2.2.02,6]dodecan-3-yl] acetate	101635457	Click to see	296.40	unknown	https://doi.org/10.1016/0031-9422(92)83718-E
[(1S,2S,3R,5R,6R,8S,12S)-3-hydroxy-1,5,9,9-tetramethyl-10-oxatricyclo[6.2.2.02,6]dodecan-12-yl] acetate	101636140	Click to see	296.40	unknown	https://doi.org/10.1016/0031-9422(92)83718-E https://doi.org/10.1016/0031-9422(95)00700-8
[(1S,2S,5S,6S,8R,9R)-1,5,9-trimethyl-10-oxatricyclo[6.2.2.02,6]dodecan-9-yl]methanol	162880534	Click to see CC1CCC2C1CC3CCC2(OC3(C)CO)C	238.37	unknown	https://doi.org/10.1002/CBDV.201000247
[(1S,3R,6R,8R)-1,5,9,9-tetramethyl-10-oxatricyclo[6.2.2.02,6]dodecan-3-yl] acetate	6325469	Click to see	280.40	unknown	via CMAUP database
1,4-Ethano-1H-cyclopent[c]oxepin-8-ol, octahydro-1,3,3,6-tetramethyl-, acetate, (1S,4R,5aR,6R,8R,8aS)-	78407203	Click to see CC1CC(C2C1CC3CCC2(OC3(C)C)C)OC(=O)C	280.40	unknown	https://doi.org/10.1248/CPB.43.169 https://doi.org/10.1016/0031-9422(92)83718-E https://doi.org/10.1016/0031-9422(95)00700-8
1,5,6,9,9-Pentamethyl-10-oxatricyclo[6.2.2.02,6]dodecan-3-ol	162985953	Click to see	252.39	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
1,5,6,9,9-Pentamethyl-10-oxatricyclo[6.2.2.02,6]dodecane	162965535	Click to see CC1CCC2C1(CC3CCC2(OC3(C)C)C)C	236.39	unknown	https://doi.org/10.1016/0031-9422(95)00492-P
1,5,9,9-Tetramethyl-10-oxatricyclo[6.2.2.02,6]dodecan-12-ol	12304809	Click to see	238.37	unknown	https://doi.org/10.1248/CPB.43.169
alpha-Kessyl alcohol	318771	Click to see CC1CC(C2C1CC3CCC2(OC3(C)C)C)O	238.37	unknown	https://doi.org/10.1248/CPB.43.169
Isokessane	527491	Click to see CC1CCC2C1CC3CCC2(OC3(C)C)C	222.37	unknown	https://doi.org/10.1016/0031-9422(92)83718-E
Kessane	11310616	Click to see	222.37	unknown	https://doi.org/10.1080/10412905.1999.9701152 https://doi.org/10.1135/CCCC19661113 https://doi.org/10.1016/0378-8741(88)90123-7 https://doi.org/10.1016/0031-9422(92)83718-E https://doi.org/10.1002/(SICI)1099-1026(199709/10)12:5<359::AID-FFJ660>3.0.CO;2-G
Kessanol	91747251	Click to see	238.37	unknown	https://doi.org/10.1248/CPB.43.169
Kessanyl acetate	527492	Click to see CC1CCC2C1CC3C(CC2(OC3(C)C)C)OC(=O)C	280.40	unknown	https://doi.org/10.1016/0031-9422(92)83718-E
Kessoglycol diacetate	166927	Click to see CC1CC(C2C1CC3CC(C2(OC3(C)C)C)OC(=O)C)OC(=O)C	338.40	unknown	https://doi.org/10.1016/0378-8741(88)90123-7 https://doi.org/10.1248/CPB.43.169 https://doi.org/10.1016/0031-9422(95)00700-8
Kessyl glycol	12304811	Click to see CC1CC(C2C1CC3C(CC2(OC3(C)C)C)O)O	254.36	unknown	https://doi.org/10.1248/CPB.43.169 https://doi.org/10.1016/0031-9422(92)83718-E
Valeracetate	131753132	Click to see	280.40	unknown	https://doi.org/10.1016/0031-9422(95)00700-8
> Organoheterocyclic compounds / Pyridines and derivatives
Valerianine	442555	Click to see CC1CCC2=C1C=NC=C2COC	177.24	unknown	via CMAUP database
> Organoheterocyclic compounds / Pyridines and derivatives / Methylpyridines
(+)-Actinidine	9812811	Click to see	147.22	unknown	via CMAUP database
(7S)-6,7-Dihydro-4,7-dimethyl-5H-cyclopenta(c)pyridine	68231	Click to see	147.22	unknown	https://doi.org/10.1016/S0031-9422(00)97426-0 https://doi.org/10.1016/0378-8741(88)90123-7
4,7-dimethyl-6,7-dihydro-5H-[2]pyrindine	3530562	Click to see CC1CCC2=C1C=NC=C2C	147.22	unknown	https://doi.org/10.1016/S0031-9422(00)97426-0
> Organoheterocyclic compounds / Quinolidines
CID 25084349	25084349	Click to see CCN1CC2(CCC(C34C2C(C(C31)C5(CCC6CC4C5C(=O)O6)O)O)OC)C	391.50	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives
3-(3,4-Dimethoxyphenyl)propenoic acid	1585026	Click to see	208.21	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids
3-(3-Hydroxy-4-methoxy-phenyl)-acrylic acid	92126	Click to see COC1=C(C=C(C=C1)C=CC(=O)O)O	194.18	unknown	https://doi.org/10.1002/JLAC.19576030117
Caffeic Acid	689043	Click to see	180.16	unknown	via CMAUP database
cis-Caffeic acid	1549111	Click to see C1=CC(=C(C=C1C=CC(=O)O)O)O	180.16	unknown	via CMAUP database
Isoferulic Acid	736186	Click to see	194.18	unknown	https://doi.org/10.1002/JLAC.19576030117
> Phenylpropanoids and polyketides / Coumarins and derivatives / Furanocoumarins / Angular furanocoumarins
2-(2-Oxo-8,9-dihydrofuro[2,3-h]chromen-8-yl)propan-2-yl 3-methylbutanoate	5318684	Click to see	330.40	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavones
6-Methylapigenin	9965615	Click to see	284.26	unknown	https://doi.org/10.1016/S0091-3057(03)00121-7
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-7-O-glycosides
(2S)-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2,3-dihydrochromen-4-one	129010007	Click to see	610.60	unknown	https://doi.org/10.1016/S0091-3057(03)00121-7
Hesperidin	10621	Click to see	610.60	unknown	https://doi.org/10.1016/S0091-3057(03)00121-7
Quercimeritrin	5282160	Click to see	464.40	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 7-O-methylated flavonoids
(2S)-5,7-dimethoxy-2-phenyl-3,4-dihydro-2H-1-benzopyran-4-one	689011	Click to see	284.31	unknown	via CMAUP database
(2S)-5,7-Dimethoxy-3',4'-methylenedioxyflavanone	10336604	Click to see	328.30	unknown	via CMAUP database
4H-1-Benzopyran-4-one, 2-(1,3-benzodioxol-5-yl)-5,7-dimethoxy-	11681403	Click to see	326.30	unknown	via CMAUP database
5,7-Dimethoxyflavone	88881	Click to see COC1=CC2=C(C(=C1)OC)C(=O)C=C(O2)C3=CC=CC=C3	282.29	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Pyranoflavonoids
16-Hydroxy-18-methoxy-6,8,12,21-tetraoxapentacyclo[11.8.0.02,10.05,9.015,20]henicosa-1(13),2(10),3,5(9),15,17,19-heptaen-14-one	44260091	Click to see	340.30	unknown	via CMAUP database
6-Methoxypulcherrimin	44260092	Click to see	370.30	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Homoisoflavonoids
(3E)-3-((3,4-dimethoxyphenyl)methylidene)-7-methoxychromen-4-one	5783568	Click to see	326.30	unknown	via CMAUP database
(3E)-3-(1,3-benzodioxol-5-ylmethylidene)-7-hydroxychromen-4-one	18778791	Click to see	296.27	unknown	via CMAUP database
(3E)-3-(1,3-benzodioxol-5-ylmethylidene)-7-methoxychromen-4-one	101489712	Click to see COC1=CC2=C(C=C1)C(=O)C(=CC3=CC4=C(C=C3)OCO4)CO2	310.30	unknown	via CMAUP database
(3E)-3-[(3-hydroxy-4-methoxyphenyl)methylidene]-6,7-dimethoxychromen-4-one	44475180	Click to see	342.30	unknown	via CMAUP database
(3E)-3-[(4-hydroxyphenyl)methylidene]-7-methoxychromen-4-one	14079440	Click to see	282.29	unknown	via CMAUP database
(3E)-7-hydroxy-3-[(3-hydroxy-4-methoxyphenyl)methylidene]chromen-4-one	13846662	Click to see	298.29	unknown	via CMAUP database
(e)-7-Hydroxy-3-(2',4'-dimethoxybenzylidene) chroman-4-one	101356812	Click to see COC1=CC(=C(C=C1)C=C2COC3=C(C2=O)C=CC(=C3)O)OC	312.30	unknown	via CMAUP database
(e)-7-Hydroxy-3-(3',4',5'-trimethoxybenzylidene) chroman-4-one	16082056	Click to see	342.30	unknown	via CMAUP database
(e)-7-Methoxy-3-(4'-methoxybenzylidene) chroman-4-one	6507117	Click to see	296.30	unknown	via CMAUP database
Bonducellin	14079439	Click to see	282.29	unknown	via CMAUP database
Isobonducellin	10423880	Click to see COC1=CC=C(C=C1)C=C2COC3=C(C2=O)C=CC(=C3)O	282.29	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Homoisoflavonoids / Homoisoflavans / Homoisoflavanones
(3S)-7-hydroxy-3-[(4-methoxyphenyl)methyl]-2,3-dihydrochromen-4-one	51533159	Click to see	284.31	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Linear 1,3-diarylpropanoids / Chalcones and dihydrochalcones / 2-Hydroxychalcones
2'-Hydroxy-2,3,4',6'-tetramethoxychalcone	10337542	Click to see	344.40	unknown	via CMAUP database
4,2'-Dihydroxy-4'-methoxychalcone	6537040	Click to see COC1=CC(=C(C=C1)C(=O)C=CC2=CC=C(C=C2)O)O	270.28	unknown	via CMAUP database

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Valeriana officinalis

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