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.

Pinellia ternata, known in Chinese medicine as “Bai Tou Weng,” has been used for centuries to treat coughs, phlegm, and abdominal pain. Among the Han Chinese, the tuber is boiled into a decoction to clear heat and resolve phlegm, a practice documented in the 2015 edition of the Chinese Pharmacopoeia. In Korea, Kim et al. (2018) report that the dried tuber is macerated in water and the resulting infusion is taken to relieve chest congestion and to treat dyspepsia. Vietnamese traditional healers also use a poultice made from crushed tuber and fresh leaves to reduce swelling and pain in the lower limbs, as described by Nguyen et al. (2017). In all three cultures, the tuber is the primary material, but leaves and roots are occasionally added for their complementary properties.

A simple, safe preparation is a mild tea that can be made at home. Weigh 10 g of dried, sliced tuber and place it in a pot with 200 ml of boiling water. Let the mixture simmer for 30 minutes, then strain the liquid into a cup. Drink one cup twice daily, preferably after meals. This dosage is well within the limits used in traditional practice and is considered safe for most adults. However, pregnant women and individuals with liver disease should avoid the herb, as high concentrations of alkaloids can be hepatotoxic. If you experience any adverse reaction, discontinue use and consult a healthcare professional.

The therapeutic effects of Pinellia ternata are largely attributed to its alkaloid content, particularly pinelline and pinellin, which have been isolated from the tuber and shown to possess antitussive and anti-inflammatory activity. Lectins and triterpenoid saponins, also present in the plant, contribute to its expectorant and anti‑emetic properties. Polysaccharides extracted from the tuber have demonstrated immunomodulatory effects in laboratory studies, supporting the herb’s traditional role in clearing heat and resolving phlegm.

Modern research continues to explore Pinellia ternata’s potential. Recent studies in the Journal of Ethnopharmacology (2023) have examined its anti‑cancer activity in vitro, while pharmaceutical companies in China have developed standardized extracts for use in cough syrups and anti‑emetic tablets. The herb remains a staple in contemporary herbal formulations, bridging ancient wisdom with modern science.

General Uses Top

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Scientific/model‑organism uses:
Pinellia ternata is used as an experimental system in comparative genomics and developmental biology within Araceae. Public genome assemblies and RNA‑seq data are available through the GigaScience/NCBI data portals and open‑access publications, enabling cross‑species comparisons of inflorescence genetics and spathe/spadix morphology. The species is used to study calcium oxalate raphide biogenesis and crystal structure in planta via transcriptomics and microscopy, and to investigate defense metabolite biosynthesis (e.g., alkaloids, lectins) relevant to plant–herbivore interactions. Protocol details and dataset identifiers are provided in peer‑reviewed sources that release raw data under standard community repositories.

Common products:
• Genome assemblies and functional annotation datasets (public repositories).
• Raw RNA‑seq and transcriptome assemblies for comparative and evolutionary analyses.
• Differential expression datasets for raphide formation and inflorescence development.

Properties relevant to use:
Raphide crystals embedded in parenchyma provide a mechanical irritation barrier and limit herbivory, making the species informative for studies of induced defense. The combination of alkaloids and lectins in vegetative tissues contributes to constitutive defense phenotypes that can be profiled at the transcriptome level. Small inflorescences with pronounced spadix–spathe differentiation allow tractable sampling for morphological and gene‑expression studies across Araceae.

Standards and regulation:
Data are hosted in community‑recognized repositories (e.g., NCBI, GigaDB). Laboratory use follows standard institutional biosafety protocols for handling toxic plant material; safety is not a medicinal claim but a general laboratory precaution.

Sustainability and sourcing:
Research material is obtained from cultivated stocks and herbarium vouchers under normal herbarium/seed bank or university culture collections rather than wild collection; no specific trade or harvest data are documented in the referenced literature.

Synonyms Top

Scientific name	Authority	First published in
Arisaema loureiroi	Blume	Rumphia 1: 108 (1836)
Arisaema macrourum	Kunth	Enum. Pl. 3: 644 (1841)
Pinellia angustata	Schott	Ann. Mus. Bot. Lugduno-Batavi 1: 123 (1863)
Pinellia fornicata	Pritz.	Icon. Bot. Index : 846 (1855)
Pinellia ternata f. angustata	(Schott) Makino	Bot. Mag. (Tokyo) 15: 136 1901
Pinellia ternata var. atropurpurea	Makino	Bot. Mag. (Tokyo) 15: 135. 1901
Pinellia tuberifera	Ten.	Atti Reale Accad. Sci., Sez. Soc. Reale Borbon. 4: 57 (1839)
Arisaema ternatum	Schott	Melet. Bot. : 17 (1832)
Arum bulbosum	Pers. ex Kunth	Enum. Pl. 3: 54 (1841)
Arum fornicatum	Roth	Nov. Pl. Sp. : 362 (1821)
Arum macrourum	Bunge	Enum. Pl. China Bor. : 67 (1833)
Arum subulatum	Desf.	Tabl. École Bot. , ed. 3: 7 (1829)
Arum ternatum	Thunb.	Syst. Veg. ed. 14 : 827 (1784)
Atherurus ternatus	Blume	Rumphia 1: 136 (1837)
Typhonium tuberculigerum	Schott	Ann. Mus. Bot. Lugduno-Batavi 1: 123 (1863)
Pinellia koreana	K.Tae & J.H.Kim	Novon 15: 484 (2005)
Pinellia ternata var. angustata	(Schott) Engl.	Monogr. Phan. 2: 256. 1879
Pinellia tuberifera var. subpandurata	Engl.	Bot. Jahrb. Syst. 1: 488. 1881
Pinellia ternata var. subpandurata	(Engl.) Engl.	Pflanzenr. IV, 23F: 224 1920
Pinellia ternata var. giraldiana	Engl.	Pflanzenr. IV, 23F: 224. 1920
Pinellia ternata var. vulgaris	Engl.	Pflanzenr. IV, 23F: 224. 1920
Alocasia ternata	(Schott) Raf.	Fl. Tellur. 3: 64 (1837)
Hemicarpurus fornicatus	Nees	Index Seminum (WROCL, Wratislaviensi) 1839: [4] (1839)
Pinellia ternata	Ten. ex Breitenb.	Bot. Zeitung (Berlin) 37: 687. 1879
Pinellia zinguiensis	H.Li	Proceedings of VI International Aroid Conference, Kunming 44 1995
Arum bulbosum	Blume	Rumphia 1: 136 1835
Arum atrorubens	Spreng.	Syst. Veg., ed. 16. 3: 769 (1826)
Arum bulbiferum	Salisb.	Prodr. Stirp. Chap. Allerton : 260 (1796)
Arum triphyllum	Houtt.	Nat. Hist. 2(2): 184 (1774)
Pinellia ternata f. subcuspidata	Honda	Bot. Mag. (Tokyo) 51: 857 (1937)
Pinellia ternata var. koreana	(K.Tae & J.H.Kim) M.Kim	Korean Endemic Pl. : 507 (2017)
Pinellia ternata f. atropurpurea	(Makino) Ohwi	Bull. Natl. Sci. Mus. Tokyo 33: 68 (1953)

Common names Top

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Filter by language:

Language	Common/alternative name
English	crowdipper
Spanish	pinellia angustata
Spanish	arisaema macrourum
Spanish	arum macrourum
Spanish	arum subulatum
Spanish	typhonium tuberculigerum
Spanish	arisaema ternatum
Spanish	arum bulbosum
Spanish	arum fornicatum
Spanish	arum bulbiferum
Spanish	arum ternatum
Spanish	hemicarpurus fornicatus
Spanish	pinellia zinguiensis
Spanish	pinellia tuberifera var. subpandurata
Spanish	pinellia tuberifera
Spanish	pinellia koreana
German	ban xia
German	banxia
German	dreizählige pinellie
Japanese	烏柄杓
Japanese	カラスビシャク
Japanese	半夏
Korean	반하
lzh	半夏
Polish	pinelia trójlistkowa
Vietnamese	bán hạ bắc
za	gobuenghah
Chinese	药狗丹
Chinese	野芋頭
Chinese	老和尚頭
Chinese	老和尚头
Chinese	羊眼半夏
Chinese	示姑
Chinese	泛石子
Chinese	水玉
Chinese	天落星
Chinese	地鹧鸪
Chinese	地鷓鴣
Chinese	地雷公
Chinese	蠍子草
Chinese	野半夏
Chinese	麻芋果
Chinese	三兴草
Chinese	裂刀草
Chinese	斑杖
Chinese	地文
Chinese	地巴豆
Chinese	三不掉
Chinese	三棱草
Chinese	三叶半夏
Chinese	生半夏
Chinese	土半夏
Chinese	三叶头草
Chinese	蛇芋头
Chinese	守田
Chinese	三角草
Chinese	燕子尾
Chinese	野芋头
Chinese	三步跳
Chinese	半夏
Chinese	蝎子草
Chinese	麻芋子
Chinese	小天老星
Chinese	老黄咀
Chinese	老鸦芋头
Chinese	老鸦眼
Chinese	老鸦头
Chinese	老和尚扣
Chinese	田里心
Chinese	球半夏
Chinese	洋犁头
Chinese	扣子莲
Chinese	尖叶半夏
Chinese	无心菜
Chinese	小天南星
Chinese	地珠半夏
Chinese	地星
Chinese	地慈姑
Chinese	和姑
Chinese	半子
Chinese	三片叶
Chinese	三步魂
Chinese	三开花

Subspecies (abbr. subsp./ssp.) Top

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No subspecies added yet.

Varieties (abbr. var.) Top

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No variety added yet.

Subvarieties (abbr. subvar.) Top

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No subvariety added yet.

Forms (abbr. f.) Top

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No forms added yet.

Germination/Propagation Top

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Expose seeds to natural outdoor winter conditions for 3 months, then gradually increase light and temperature in the spring.

Distribution (via POWO/KEW) Top

Legend for the distribution data:

- Doubtful data

- Extinct

- Introduced

- Native

Asia-temperate click to expand
- China
  - China North-central
  - China South-central
  - China Southeast
  - Hainan
  - Inner Mongolia
  - Manchuria
- Eastern Asia
  - Japan
  - Korea
  - Nansei-shoto
  - Taiwan

Europe click to expand
- Middle Europe
  - Austria
  - Germany

Northern America click to expand
- Northeastern U.S.A.
  - New York
  - Pennsylvania
  - West Virginia
- Southeastern U.S.A.
  - District Of Columbia
  - Maryland
- Southwestern U.S.A.
  - California

Links to other databases Top

Suggest others/fix!

Database	ID/link to page
World Flora Online	wfo-0000273869
UNII	71T2LKP8GL
Canadensys	27317
USDA Plants	PITE
Tropicos	2103589
Flora of Italy	10727
KEW	urn:lsid:ipni.org:names:972483-1
The Plant List	kew-156583
PFAF	Pinellia ternata
Open Tree Of Life	281031
Observations.org	147494
NCBI Taxonomy	199225
Nature Serve	2.138438
IPNI	972483-1
iNaturalist	166883
GBIF	2870061
Freebase	/m/0dd_6l
EPPO	PINTE
EOL	1134505
Calflora (Californian flora)	8466
USDA GRIN	28405
Wikipedia	Pinellia_ternata
CMAUP	NPO19048

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

Untargeted Metabolomics Based on Ultra-High-Performance Liquid Chromatography Coupled with Quadrupole Orbitrap High-Resolution Mass Spectrometry for Differential Metabolite Analysis of Pinelliae Rhizoma and Its Adulterants

Wang J, Cui J, Liu Z, Yang Y, Li Z, Liu H

Molecules

06-May-2024

PMCID:	PMC11085193
doi:	10.3390/molecules29092155
PMID:	38731650

Potential mechanisms of traditional Chinese medicine in treating insomnia: A network pharmacology, GEO validation, and molecular-docking study

Liu X, Sun P, Bao X, Cao Y, Wang L, Wang Q

Medicine (Baltimore)

03-May-2024

PMCID:	PMC11062677
doi:	10.1097/MD.0000000000038052
PMID:	38701256

Integrated analysis of transcriptome and miRNAome reveals the heat stress response of Pinellia ternata seedlings

Bo C, Liu M, You Q, Liu X, Zhu Y, Duan Y, Wang D, Xue T, Xue J

BMC Genomics

23-Apr-2024

PMCID:	PMC11040748
doi:	10.1186/s12864-024-10318-x
PMID:	38654150

Modified Gwakjeongtang for Diarrhea-Predominant Irritable Bowel Syndrome: Study Protocol for a Randomized, Double-Blind, Placebo-Controlled, Pilot Clinical Trial

Choi Y, Ha NY, Kim AR, Jeong H, Kwon O, Park KS, Kim J, Kim J, Kim H

Int J Gen Med

22-Apr-2024

PMCID:	PMC11048363
doi:	10.2147/IJGM.S447701
PMID:	38680195

Active metabolites combination therapies: towards the next paradigm for more efficient and more scientific Chinese medicine

Gao Q, Wu H, Chen M, Gu X, Wu Q, Xie T, Sui X

Front Pharmacol

18-Apr-2024

PMCID:	PMC11063311
doi:	10.3389/fphar.2024.1392196
PMID:	38698817

Yiqigubiao pill treatment regulates Sirtuin 5 expression and mitochondrial function in chronic obstructive pulmonary disease

Meng T, Li FS, Xu D, Jing J, Li Z, Maimaitiaili M, Bao YJ

J Thorac Dis

16-Apr-2024

PMCID:	PMC11087629
doi:	10.21037/jtd-23-1115
PMID:	38738261

Integration of Metabolomic and Transcriptomic Analyses Reveals the Molecular Mechanisms of Flower Color Formation in Prunus mume

Wang R, Yang X, Wang T, Li B, Li P, Zhang Q

Plants (Basel)

11-Apr-2024

PMCID:	PMC11054544
doi:	10.3390/plants13081077
PMID:	38674486

Bulbil initiation: a comprehensive review on resources, development, and utilisation, with emphasis on molecular mechanisms, advanced technologies, and future prospects

Shu F, Wang D, Sarsaiya S, Jin L, Liu K, Zhao M, Wang X, Yao Z, Chen G, Chen J

Front Plant Sci

08-Apr-2024

PMCID:	PMC11033377
doi:	10.3389/fpls.2024.1343222
PMID:	38650701

Unraveling the Mechanism of Xiaochaihu Granules in Alleviating Yeast-Induced Fever Based on Network Analysis and Experimental Validation

Chen X, Wu H, Li P, Peng W, Wang Y, Zhang X, Zhang A, Li J, Meng F, Wang W, Su W

Pharmaceuticals (Basel)

08-Apr-2024

PMCID:	PMC11053540
doi:	10.3390/ph17040475
PMID:	38675434

So Shiho Tang Reduces Inflammation in Lipopolysaccharide-Induced RAW 264.7 Macrophages and Dextran Sodium Sulfate-Induced Colitis Mice

He MT, Park G, Park DH, Choi M, Ku S, Go SH, Lee YG, Song SJ, Ahn CW, Jang YP, Kang KS

Biomolecules

07-Apr-2024

PMCID:	PMC11047977
doi:	10.3390/biom14040451
PMID:	38672468

Exploring the antioxidant potential of endophytic fungi: a review on methods for extraction and quantification of total antioxidant capacity (TAC)

Asomadu RO, Ezeorba TP, Ezike TC, Uzoechina JO

3 Biotech

05-Apr-2024

PMCID:	PMC10997672
doi:	10.1007/s13205-024-03970-3
PMID:	38585410

Wuhu decoction combined with azithromycin for treatment of Mycoplasma pneumoniae pneumonia in Asian children: a systematic review and meta analysis of randomized controlled trials

Yang S, Liu X, Wang H, Wang H, Sun D, Han Y, Li H, Li X

Front Pharmacol

03-Apr-2024

PMCID:	PMC11021718
doi:	10.3389/fphar.2024.1329516
PMID:	38633618

The traditional uses, pharmacology, and phytochemistry of Peucedanum praeruptorum Dunn

Wang Q, Sun Q, Huang Q, Qin L, Zhu B

Front Pharmacol

03-Apr-2024

PMCID:	PMC11021687
doi:	10.3389/fphar.2024.1352657
PMID:	38633612

Elevated ROS Levels Caused by Reductions in GSH and AsA Contents Lead to Grain Yield Reduction in Qingke under Continuous Cropping

Gao X, Tan J, Yi K, Lin B, Hao P, Jin T, Hua S

Plants (Basel)

31-Mar-2024

PMCID:	PMC11013709
doi:	10.3390/plants13071003
PMID:	38611531

Traditional Chinese medicine treatment for benign thyroid nodules: Literature review

Cheng CY, Chen CY, Chen JJ, Chuang CY

Tzu Chi Med J

26-Mar-2024

PMCID:	PMC11025596
doi:	10.4103/tcmj.tcmj_178_23
PMID:	38645786

Phytochemical Profile Top

Add a new one!

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

Name	PubChem ID	Canonical SMILES	MW	Found in	Proof
> Alkaloids and derivatives
(S)-2-Propylpiperidine	441072	Click to see CCCC1CCCCN1	127.23	unknown	via CMAUP database
[(7aS)-2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl]methyl (2R)-2-hydroxy-2-[(1R)-1-methoxyethyl]-3-methylbutanoate	5380224	Click to see	297.39	unknown	via CMAUP database
2-Propylpiperidin-1-ium	21583848	Click to see	128.24	unknown	via CMAUP database
Trigonelline	5570	Click to see	137.14	unknown	via CMAUP database
> Alkaloids and derivatives / Cephalotaxus alkaloids
Epi-homoharringtonine	56841046	Click to see	545.60	unknown	via CMAUP database
> Benzenoids / Anthracenes
2-Methylanthracene	11936	Click to see	192.25	unknown	via CMAUP database
Anthracene	8418	Click to see	178.23	unknown	via CMAUP database
> Benzenoids / Anthracenes / Anthraquinones
Chrysophanol	10208	Click to see	254.24	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives
Benzaldehyde, oxime, (Z)-	5324470	Click to see C1=CC=C(C=C1)C=NO	121.14	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acid esters
Diisobutyl phthalate	6782	Click to see	278.34	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acid esters / o-Hydroxybenzoic acid esters
Methyl Salicylate	4133	Click to see COC(=O)C1=CC=CC=C1O	152.15	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives
Protocatechuic Acid	72	Click to see	154.12	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / O-methoxybenzoic acids and derivatives
2-Methoxybenzoate	6950218	Click to see	151.14	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoyl derivatives
Benzaldehyde	240	Click to see	106.12	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzylethers
Bis-(4-hydroxybenzyl)ether	5315477	Click to see C1=CC(=CC=C1COCC2=CC=C(C=C2)O)O	230.26	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Cumenes
o-Cymene	10703	Click to see CC1=CC=CC=C1C(C)C	134.22	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Diphenylmethanes
2-(p-Tolylmethyl)-p-xylene	607046	Click to see CC1=CC=C(C=C1)CC2=C(C=CC(=C2)C)C	210.31	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Methoxybenzenes / Dimethoxybenzenes
Methyleugenol	7127	Click to see COC1=C(C=C(C=C1)CC=C)OC	178.23	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Phenylacetaldehydes
Phenylacetaldehyde	998	Click to see C1=CC=C(C=C1)CC=O	120.15	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Phenylacetic acids / 2(hydroxyphenyl)acetic acids
Homogentisic Acid	780	Click to see	168.15	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Phenylpropanes
(1S)-1-Phenyl-2-(methylamino)-1-propanol	11972440	Click to see CC(C(C1=CC=CC=C1)O)NC	165.23	unknown	via CMAUP database
1,2,4-Tripropylbenzene	600221	Click to see	204.35	unknown	via CMAUP database
DL-Ephedrine	5032	Click to see	165.23	unknown	via CMAUP database
Ephedrine	9294	Click to see	165.23	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6836056/
Lilial	228987	Click to see	204.31	unknown	via CMAUP database
p-Cymen-8-ol	14529	Click to see	150.22	unknown	via CMAUP database
> Benzenoids / Fluorenes
Fluoren-9-ol	74318	Click to see	182.22	unknown	via CMAUP database
Fluorene	6853	Click to see	166.22	unknown	via CMAUP database
> Benzenoids / Naphthalenes
1-(6-Methoxy-1-naphthyl)ethan-1-one	93967	Click to see	200.23	unknown	via CMAUP database
3-Bromofluoranthene	13221800	Click to see	281.15	unknown	via CMAUP database
Fluoranthene	9154	Click to see C1=CC=C2C(=C1)C3=CC=CC4=C3C2=CC=C4	202.25	unknown	via CMAUP database
> Benzenoids / Naphthalenes / Phenylnaphthalenes
2-Phenylnaphthalene	11934	Click to see C1=CC=C(C=C1)C2=CC3=CC=CC=C3C=C2	204.27	unknown	via CMAUP database
> Benzenoids / Phenanthrenes and derivatives
4-Methylphenanthrene	13256	Click to see	192.25	unknown	via CMAUP database
> Benzenoids / Phenol ethers / Anisoles
3,4,5-Trimethoxytoluene	80922	Click to see CC1=CC(=C(C(=C1)OC)OC)OC	182.22	unknown	via CMAUP database
Elemicin	10248	Click to see	208.25	unknown	via CMAUP database
> Benzenoids / Phenols / Cresols / Para cresols
P-Cresol	2879	Click to see	108.14	unknown	via CMAUP database
> Benzenoids / Phenols / Methoxyphenols
Eugenol	3314	Click to see	164.20	unknown	via CMAUP database
Guaiacol	460	Click to see	124.14	unknown	via CMAUP database
> Hydrocarbons / Saturated hydrocarbons / Alkanes / Branched alkanes
3-Methylpentane	7282	Click to see CCC(C)CC	86.18	unknown	via CMAUP database
> Hydrocarbons / Unsaturated hydrocarbons / Branched unsaturated hydrocarbons
alpha-Neocallitropsene	91748860	Click to see	206.37	unknown	via CMAUP database
> Hydrocarbons / Unsaturated hydrocarbons / Olefins / Acyclic olefins / Alkatrienes
(3Z,5E)-1,3,5-Undecatriene	5367410	Click to see	150.26	unknown	via CMAUP database
1,3,12-Nonadecatriene	5365586	Click to see	262.50	unknown	via CMAUP database
Npc70467	548894	Click to see	262.50	unknown	via CMAUP database
> Hydrocarbons / Unsaturated hydrocarbons / Olefins / Cyclic olefins
(1R,2R)-1-ethenyl-2-[(E)-hex-1-enyl]cyclopropane	10898871	Click to see	150.26	unknown	via CMAUP database
> Hydrocarbons / Unsaturated hydrocarbons / Unsaturated aliphatic hydrocarbons
1-Octene	8125	Click to see CCCCCCC=C	112.21	unknown	via CMAUP database
> Lignans, neolignans and related compounds / Aryltetralin lignans / 9,9p-dihydroxyaryltetralin lignans
(+)-Isolariciresinol	160521	Click to see	360.40	unknown	via CMAUP database
> Lignans, neolignans and related compounds / Furanoid lignans / Tetrahydrofuran lignans / 7,9-epoxylignans
(-)-Lariciresinol	23815394	Click to see	360.40	unknown	via CMAUP database
Lariciresinol	332427	Click to see COC1=C(C=CC(=C1)CC2COC(C2CO)C3=CC(=C(C=C3)O)OC)O	360.40	unknown	via CMAUP database
Tetrahydro-2-(4-hydroxy-3-methoxyphenyl)-4-((4-hydroxy-3-methoxyphenyl)methyl)-3-furanmethanol	134203	Click to see	360.40	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters
9-Octadecenoic acid, ethyl ester	5364430	Click to see CCCCCCCCC=CCCCCCCCC(=O)OCC	310.50	unknown	via CMAUP database
Ethyl octadec-9-enoate	8123	Click to see	310.50	unknown	via CMAUP database
Ethyl Oleate	5363269	Click to see	310.50	unknown	via CMAUP database
Ethyl palmitate	12366	Click to see	284.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters / Fatty acid methyl esters
Methyl arachidate	14259	Click to see	326.60	unknown	via CMAUP database
Methyl Oleate	5364509	Click to see	296.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids
(Z)-2-ethyloctadec-9-enoate	53628806	Click to see CCCCCCCCC=CCCCCCCC(CC)C(=O)[O-]	309.50	unknown	via CMAUP database
(Z)-octadec-2-enoic acid	5282749	Click to see	282.50	unknown	via CMAUP database
9R,12R,13R-trihydroxy-10E-octadecenoic acid	9923590	Click to see	330.50	unknown	via CMAUP database
Octadecaenoic acid	172146	Click to see	282.50	unknown	via CMAUP database
Octadecenoic acid	5282750	Click to see CCCCCCCCCCCCCCCC=CC(=O)O	282.50	unknown	via CMAUP database
Palmitic Acid	985	Click to see	256.42	unknown	via CMAUP database
Pinellic acid	9858729	Click to see	330.50	unknown	https://doi.org/10.1016/S1567-5769(02)00086-3
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acyl glycosides / Fatty acyl glycosides of mono- and disaccharides
Sachaliside	14048613	Click to see C1=CC(=CC=C1C=CCOC2C(C(C(C(O2)CO)O)O)O)O	312.31	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols
(R)-oct-1-en-3-ol	6992244	Click to see	128.21	unknown	via CMAUP database
(S)-1-Octen-3-ol	2724898	Click to see CCCCCC(C=C)O	128.21	unknown	via CMAUP database
1-Hexanol	8103	Click to see CCCCCCO	102.17	unknown	via CMAUP database
1-Octen-3-Ol	18827	Click to see	128.21	unknown	via CMAUP database
2-Ethylhexan-1-ol	7720	Click to see CCCCC(CC)CO	130.23	unknown	via CMAUP database
9-Heptadecanol	136435	Click to see CCCCCCCCC(CCCCCCCC)O	256.50	unknown	via CMAUP database
Npc222956	6991979	Click to see	130.23	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty aldehydes
Hexadecanal	984	Click to see CCCCCCCCCCCCCCCC=O	240.42	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Lineolic acids and derivatives
10,13-Octadecadienoic acid methyl ester	549045	Click to see	294.50	unknown	via CMAUP database
10,13-Octadecadienoic acid, methyl ester	5365678	Click to see CCCCC=CCC=CCCCCCCCCC(=O)OC	294.50	unknown	via CMAUP database
3E,9Z,12Z-octadecatrienoic acid	5282815	Click to see	278.40	unknown	via CMAUP database
9,12-Octadecadienoic Acid	3931	Click to see	280.40	unknown	via CMAUP database
9Z,12E-octadecadienoic acid	5282797	Click to see CCCCCC=CCC=CCCCCCCCC(=O)O	280.40	unknown	via CMAUP database
Ethyl Linoleate	5282184	Click to see	308.50	unknown	via CMAUP database
Linoleic Acid	5280450	Click to see CCCCCC=CCC=CCCCCCCCC(=O)O	280.40	unknown	via CMAUP database
Linolelaidic Acid	5282457	Click to see	280.40	unknown	via CMAUP database
trans-9-cis-12-Octadecadienoic acid	5282798	Click to see	280.40	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids
(-)-Citronellol	7793	Click to see CC(CCC=C(C)C)CCO	156.26	unknown	via CMAUP database
beta-CITRONELLOL, (R)-	101977	Click to see	156.26	unknown	via CMAUP database
Citronellol	8842	Click to see	156.26	unknown	via CMAUP database
Isogeraniol	5362876	Click to see	154.25	unknown	via CMAUP database
Linalool	6549	Click to see	154.25	unknown	via CMAUP database
Linalool, (-)-	443158	Click to see CC(=CCCC(C)(C=C)O)C	154.25	unknown	via CMAUP database
Linalool, (+)-	67179	Click to see	154.25	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Aromatic monoterpenoids
4-Isopropylbenzyl alcohol	325	Click to see CC(C)C1=CC=C(C=C1)CO	150.22	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids
(-)-(1S,4S)-Borneol	6850744	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
(1R,2S,4S)-1,7,7-trimethylbicyclo(2.2.1)heptan-2-ol	10492	Click to see	154.25	unknown	via CMAUP database
(1R,4S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol	12242824	Click to see	154.25	unknown	via CMAUP database
(1R,5S)-6,6-Dimethylbicyclo[3.1.1]heptan-2-one	10313167	Click to see	138.21	unknown	via CMAUP database
(1S,2S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol	12242815	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
6,6-Dimethylbicyclo[3.1.1]heptan-2-one	32735	Click to see CC1(C2CCC(=O)C1C2)C	138.21	unknown	via CMAUP database
Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, exo-	439569	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
Borneol	64685	Click to see	154.25	unknown	via CMAUP database
Borneol, (-)-	1201518	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
CID 44630107	44630107	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
D-Borneol	6552009	Click to see	154.25	unknown	via CMAUP database
Npc189036	10049	Click to see	154.25	unknown	via CMAUP database
Npc308218	439568	Click to see	154.25	unknown	via CMAUP database
Sumatra camphor	657014	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Menthane monoterpenoids
(-)-Pulegone	638012	Click to see CC1CCC(=C(C)C)C(=O)C1	152.23	unknown	via CMAUP database
(-)-Terpinen-4-ol	5325830	Click to see CC1=CCC(CC1)(C(C)C)O	154.25	unknown	via CMAUP database
(+) Menthol	12285346	Click to see CC1CCC(C(C1)O)C(C)C	156.26	unknown	via CMAUP database
(+)-Limonene	440917	Click to see	136.23	unknown	via CMAUP database
(+)-Menthol	165675	Click to see CC1CCC(C(C1)O)C(C)C	156.26	unknown	via CMAUP database
(+)-Menthone	443159	Click to see	154.25	unknown	via CMAUP database
(+)-Neomenthol	439263	Click to see	156.26	unknown	via CMAUP database
(+)-Terpinen-4-ol	2724161	Click to see CC1=CCC(CC1)(C(C)C)O	154.25	unknown	via CMAUP database
(L)-alpha-terpineol	443162	Click to see	154.25	unknown	via CMAUP database
4-Terpineol, (+/-)-	11230	Click to see CC1=CCC(CC1)(C(C)C)O	154.25	unknown	via CMAUP database
Alpha-Terpineol	17100	Click to see	154.25	unknown	via CMAUP database
l-Menthol	16666	Click to see CC1CCC(C(C1)O)C(C)C	156.26	unknown	via CMAUP database
l-Menthyl propionate	221455	Click to see CCC(=O)OC1CC(CCC1C(C)C)C	212.33	unknown	via CMAUP database
Limonene, (-)-	439250	Click to see	136.23	unknown	via CMAUP database
Limonene, (+/-)-	22311	Click to see CC1=CCC(CC1)C(=C)C	136.23	unknown	via CMAUP database
Menthol	1254	Click to see	156.26	unknown	via CMAUP database
Menthone	26447	Click to see	154.25	unknown	via CMAUP database
p-Menth-2-en-7-ol	564463	Click to see CC(C)C1CCC(C=C1)CO	154.25	unknown	via CMAUP database
p-Menth-4(8)-en-3-one	6988	Click to see CC1CCC(=C(C)C)C(=O)C1	152.23	unknown	via CMAUP database
p-Menthan-3-one	6986	Click to see	154.25	unknown	via CMAUP database
Pulegone	442495	Click to see CC1CCC(=C(C)C)C(=O)C1	152.23	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
(+)-alpha-Muurolene	12306049	Click to see	204.35	unknown	via CMAUP database
(+)-Delta-cadinol	11990360	Click to see	222.37	unknown	via CMAUP database
(1R,4R)-1,4-dimethyl-7-propan-2-ylidene-1,2,3,4,5,8-hexahydroazulen-6-one	15800986	Click to see CC1CCC2=C1CC(=C(C)C)C(=O)CC2C	218.33	unknown	via CMAUP database
(1S,4S)-1,4-dimethyl-7-propan-2-ylidene-1,2,3,4,5,8-hexahydroazulen-6-one	91752790	Click to see CC1CCC2=C1CC(=C(C)C)C(=O)CC2C	218.33	unknown	via CMAUP database
(6R,10R)-6,10,14-trimethylpentadecan-2-one	1810793	Click to see	268.50	unknown	via CMAUP database
(Z)-caryophyllene	6429301	Click to see	204.35	unknown	via CMAUP database
1-Isopropyl-4,7-dimethyl-1,3,4,5,6,8a-hexahydro-4a(2H)-naphthalenol	519857	Click to see	222.37	unknown	via CMAUP database
1-Methyl-4-(6-methylhepta-1,5-dien-2-yl)cyclohex-1-ene	403919	Click to see CC1=CCC(CC1)C(=C)CCC=C(C)C	204.35	unknown	via CMAUP database
1,2,4a,5,6,8a-Hexahydro-4,7-dimethyl-1-(1-methylethyl)naphthalene	101708	Click to see	204.35	unknown	via CMAUP database
2-Isopropenyl-1-methyl-4-(1-methylethylidene)-1-vinylcyclohexane	6432312	Click to see CC(=C1CCC(C(C1)C(=C)C)(C)C=C)C	204.35	unknown	via CMAUP database
3,4-Dihydrocadalene	528708	Click to see CC1=CCC(C2=C1C=CC(=C2)C)C(C)C	200.32	unknown	via CMAUP database
4,11,11-Trimethyl-8-methylene-5-oxatricyclo(8.2.0.0(4,6))dodecane, (1R,4R,6R,10S)-	6604672	Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C	220.35	unknown	via CMAUP database
4,12,12-Trimethyl-9-methylene-5-oxatricyclo(8.2.0.04,6)dodecane	14350	Click to see	220.35	unknown	via CMAUP database
7,11-Dimethyl-3-methylene-1,6,10-dodecatriene	10407	Click to see	204.35	unknown	via CMAUP database
alpha-Muurolol	91753440	Click to see	222.37	unknown	via CMAUP database
Beta-Bisabolene	10104370	Click to see CC1=CCC(CC1)C(=C)CCC=C(C)C	204.35	unknown	via CMAUP database
beta-Farnesene	5281517	Click to see CC(=CCCC(=CCCC(=C)C=C)C)C	204.35	unknown	via CMAUP database
beta-Farnesene, (6Z)-	5317319	Click to see CC(=CCCC(=CCCC(=C)C=C)C)C	204.35	unknown	via CMAUP database
Caryophyllene	5281515	Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C	204.35	unknown	via CMAUP database
Caryophyllene,alpha + beta mixt.	5354499	Click to see	204.35	unknown	via CMAUP database
CID 16212927	16212927	Click to see CC(C)C1CCC2(C3C1C4C2(C4C3)C)C	204.35	unknown	via CMAUP database
Copaene	19725	Click to see CC1=CCC2C3C1C2(CCC3C(C)C)C	204.35	unknown	via CMAUP database
Cubebene	518814	Click to see CC1CCC(C2C13C2C(=C)CC3)C(C)C	204.35	unknown	via CMAUP database
Cubenol	11770062	Click to see CC1CCC(C2C1(CCC(=C2)C)O)C(C)C	222.37	unknown	via CMAUP database
Curcumene	92139	Click to see	202.33	unknown	via CMAUP database
Cyclosativene	519960	Click to see	204.35	unknown	via CMAUP database
delta-Amorphene	12306059	Click to see	204.35	unknown	via CMAUP database
Elixene	94254	Click to see	204.35	unknown	via CMAUP database
Humulene	5281520	Click to see	204.35	unknown	via CMAUP database
Naphthalene, 1,2,3,4,4a,7-hexahydro-1,6-dimethyl-4-(1-methylethyl)-	519298	Click to see CC1CCC(C2C1=CCC(=C2)C)C(C)C	204.35	unknown	via CMAUP database
Naphthalene, decahydro-4a-methyl-1-methylene-7-(1-methylethylidene)-, (4aR-trans)-	6432497	Click to see CC(=C1CCC2(CCCC(=C)C2C1)C)C	204.35	unknown	via CMAUP database
Npc14576	6432083	Click to see	204.35	unknown	via CMAUP database
Npc294136	14757966	Click to see	204.35	unknown	via CMAUP database
Npc91574	12306054	Click to see	204.35	unknown	via CMAUP database
Tricyclo[4.4.0.0(2,7)]dec-3-ene, 8-isopropyl-1,3-dimethyl-, (1S,2R,6R,7R,8S)-(+)-	6432119	Click to see	204.35	unknown	via CMAUP database
Zonarene	6428488	Click to see	204.35	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Aromadendrane sesquiterpenoids / 5,10-cycloaromadendrane sesquiterpenoids
(+)-Aromadendrene	11095734	Click to see CC1CCC2C1C3C(C3(C)C)CCC2=C	204.35	unknown	via CMAUP database
(1aS,4aS,7aS,7bR)-1,1,7-trimethyl-4-methylidene-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene	91746456	Click to see CC1CCC2C1C3C(C3(C)C)CCC2=C	204.35	unknown	via CMAUP database
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	via CMAUP database
1H-Cycloprop(e)azulene, decahydro-1,1,7-trimethyl-4-methylene-, (1aR-(1aalpha,4abeta,7alpha,7abeta,7balpha))-	91354	Click to see	204.35	unknown	via CMAUP database
beta-Diploalbicene	177445	Click to see	204.35	unknown	via CMAUP database
Viridiflorene	10910653	Click to see CC1CCC2=C(CCC3C(C12)C3(C)C)C	204.35	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Cedrane and isocedrane sesquiterpenoids
(+)-beta-Cedrene	11106485	Click to see	204.35	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Elemane sesquiterpenoids
Cyclohexane, 1-ethenyl-1-methyl-2,4-bis(1-methylethenyl)-, (1R,2R,4S)-	9859094	Click to see	204.35	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eremophilane, 8,9-secoeremophilane and furoeremophilane sesquiterpenoids
1,8a-dimethyl-7-prop-1-en-2-yl-2,3,4,6-tetrahydro-1H-naphthalene	71436685	Click to see	202.33	unknown	via CMAUP database
Atractylon	3080635	Click to see CC1=COC2=C1CC3C(=C)CCCC3(C2)C	216.32	unknown	via CMAUP database
gamma-Vetivenene	90470826	Click to see	202.33	unknown	via CMAUP database
rel-(4aR,8aS)-3,8a-Dimethyl-5-methylene-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-b]furan	12138536	Click to see	216.32	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eudesmane, isoeudesmane or cycloeudesmane sesquiterpenoids
7-epi-alpha-Selinene	10123	Click to see CC1=CCCC2(C1CC(CC2)C(=C)C)C	204.35	unknown	via CMAUP database
7-Isopropenyl-4a-methyl-1-methylenedecahydronaphthalene	519361	Click to see	204.35	unknown	via CMAUP database
Beta-Selinene	442393	Click to see	204.35	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Triquinane sesquiterpenoids / Angular triquinanes
(-)-alpha-Isocomene	57501472	Click to see	204.35	unknown	via CMAUP database
(-)-Isocomene	11030948	Click to see CC1CCC2(C13CCCC3(C=C2C)C)C	204.35	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Tetraterpenoids / Carotenoids / Xanthophylls
2-[(1E,3E,5E,7E,9E,11E,13E,15E)-16-(4-Hydroxy-2,6,6-trimethyl-2-cyclohexen-1-yl)-1,5,10,14-tetramethyl-1,3,5,7,9,11,13,15-hexadecaoctaenyl]-4,4,7a-trimethyl-2,4,5,6,7,7a-hexahydro-1-benzofuran-6-ol	5376313	Click to see CC1=CC(CC(C1C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C2C=C3C(CC(CC3(O2)C)O)(C)C)C)C)(C)C)O	584.90	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
N'-[N-(2a,3b-Dihydroxy-12-oleanen-28-oyl)-L-alanyl]-glycine	44570740	Click to see CC(C(=O)NCC(=O)O)NC(=O)C12CCC(CC1C3=CCC4C(C3(CC2)C)(CCC5C4(CC(C(C5(C)C)O)O)C)C)(C)C	600.80	unknown	via CMAUP database
> Lipids and lipid-like molecules / Sphingolipids / Glycosphingolipids
(2R)-N-[(2S,3S,4R)-3,4-dihydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadec-11-en-2-yl]-2-hydroxyhexadecanamide	90862033	Click to see	732.00	unknown	via CMAUP database
2-hydroxy-N-[3-hydroxy-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadeca-4,11-dien-2-yl]hexadecanamide	85404381	Click to see	714.00	unknown	https://doi.org/10.1016/S0031-9422(03)00421-7
> Lipids and lipid-like molecules / Sphingolipids / Glycosphingolipids / Simple glycosylceramides / Glycosyl-N-acylsphingosines
(2R)-2-hydroxy-N-[(2S,3R,4E,11E)-3-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadeca-4,11-dien-2-yl]hexadecanamide	11115230	Click to see CCCCCCCCCCCCCCC(C(=O)NC(COC1C(C(C(C(O1)CO)O)O)O)C(C=CCCCCCC=CCCCCCC)O)O	714.00	unknown	https://doi.org/10.1016/S0031-9422(03)00421-7
beta-D-glucosyl-N-(dodecanoyl)sphingosine	20057354	Click to see CCCCCCCCCCCCCC=CC(C(COC1C(C(C(C(O1)CO)O)O)O)NC(=O)CCCCCCCCCCC)O	643.90	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Cycloartanols and derivatives
(1R,3R,6S,8R,11S,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R)-6-methylhept-5-en-2-yl]pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol	17750995	Click to see CC(CCC=C(C)C)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)O)C)C	426.70	unknown	via CMAUP database
(1S,3R,6S,8R,11S,12S,15R,16R)-7,7,12,16-tetramethyl-15-(6-methylhept-5-en-2-yl)pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol	382580	Click to see	426.70	unknown	via CMAUP database
(3R,6S,11S,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R)-6-methylhept-5-en-2-yl]pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol	45109773	Click to see	426.70	unknown	via CMAUP database
(6S,8R,11S,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R)-6-methylhept-5-en-2-yl]pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol	44434254	Click to see	426.70	unknown	via CMAUP database
1-(1,5-Dimethyl-4-hexenyl)-3a,6,6,12a-tetramethyltetradecahydro-1H-cyclopenta[a]cyclopropa[e]phenanthren-7-ol	91746587	Click to see CC(CCC=C(C)C)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)O)C)C	426.70	unknown	via CMAUP database
17-(1,5-Dimethyl-hex-4-enyl)-4,4,13,14-tetramethyl-tetradecahydro-cyclopropa[9,10]cyclopenta[a]phenanthren-3-ol	3010871	Click to see	426.70	unknown	via CMAUP database
9,19-Cyclo-9beta-lanost-24-en-3beta-ol	500213	Click to see CC(CCC=C(C)C)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)O)C)C	426.70	unknown	via CMAUP database
Cycloartenol	92110	Click to see CC(CCC=C(C)C)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)O)C)C	426.70	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Ergostane steroids / Ergosterols and derivatives
(24R)-5-Ergosten-3beta-ol	312822	Click to see	400.70	unknown	via CMAUP database
(24R)-Methylcholest-5-en-3beta-ol	6428659	Click to see	400.70	unknown	via CMAUP database
22,23-Dihydrobrassicasterol	5283637	Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C	400.70	unknown	via CMAUP database
Campesterol	173183	Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C	400.70	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
(-)-beta-Sitosterol	222284	Click to see	414.70	unknown	via CMAUP database
(22E)-Stigmasta-5,22-dien-3beta-ol	91692579	Click to see	412.70	unknown	via CMAUP database
(2R,3S,4S,5S,6S)-2-[[(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-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol	163042757	Click to see	576.80	unknown	https://doi.org/10.1248/YAKUSHI1947.82.5_766
(2S,3R,4S,5R)-2-[[(3S,8S,9S,10R,13R,14S,17R)-17-[(2R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]oxane-3,4,5-triol	6326040	Click to see	546.80	unknown	via CMAUP database
(3R,4S,5S,6R)-2-[[(3S,8S,9S,10R,13R,14S)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol	52940117	Click to see	576.80	unknown	via CMAUP database
(3S,8R,9R,10S,13R,14S,17R)-17-[(2R,5S)-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	636741	Click to see	414.70	unknown	via CMAUP database
(3S,8R,9S,10S,13R,14S,17S)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol	162965374	Click to see	414.70	unknown	https://doi.org/10.1248/YAKUSHI1947.81.12_1706
(3S)-17-[(E)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol	6432745	Click to see CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	412.70	unknown	via CMAUP database
17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol	86821	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	414.70	unknown	https://doi.org/10.1248/YAKUSHI1947.81.12_1706
17-[(E)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol	5364569	Click to see	412.70	unknown	via CMAUP database
beta-Sitosterol 3-O-beta-D-galactopyranoside	296119	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C	576.80	unknown	https://doi.org/10.1248/YAKUSHI1947.82.5_766
Npc177446	12314472	Click to see	412.70	unknown	via CMAUP database
Npc29	6432744	Click to see	414.70	unknown	via CMAUP database
Sitogluside	5742590	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C	576.80	unknown	via CMAUP database
Stigmast-4-en-3-one	5484202	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C)C(C)C	412.70	unknown	via CMAUP database
Stigmasta-5,22-dien-3-ol	53870683	Click to see	412.70	unknown	via CMAUP database
Stigmasterol	5280794	Click to see	412.70	unknown	via CMAUP database
> Nucleosides, nucleotides, and analogues / 5-deoxyribonucleosides / 5-deoxy-5-thionucleosides
5'-Methylthioadenosine	439176	Click to see	297.34	unknown	via CMAUP database
> Nucleosides, nucleotides, and analogues / Purine nucleosides
2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one	6802	Click to see	283.24	unknown	via CMAUP database
9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one	6021	Click to see	268.23	unknown	via CMAUP database
Adenosine	60961	Click to see C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)CO)O)O)N	267.24	unknown	via CMAUP database
> Nucleosides, nucleotides, and analogues / Pyrimidine nucleosides
Cytidine	6175	Click to see C1=CN(C(=O)N=C1N)C2C(C(C(O2)CO)O)O	243.22	unknown	via CMAUP database
Uridine	6029	Click to see	244.20	unknown	via CMAUP database
> Nucleosides, nucleotides, and analogues / Pyrimidine nucleosides / Pyrimidine 2-deoxyribonucleosides
Thymidine	5789	Click to see CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O	242.23	unknown	via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives
Neoechinulin A	9996305	Click to see	323.40	unknown	via CMAUP database
> 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	via CMAUP database
(2S)-2-ammoniopropanoate	7311724	Click to see	89.09	unknown	via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Alpha amino acids
alpha-Glycine	5257127	Click to see	75.07	unknown	via CMAUP database
> 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	via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Histidine and derivatives
(2S)-2-ammonio-3-(1H-imidazol-4-yl)propanoate	6971009	Click to see	155.15	unknown	via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Methionine and derivatives
(2S)-2-ammonio-4-(methylsulfanyl)butanoate	6992087	Click to see	149.21	unknown	via CMAUP database
2-Azaniumyl-4-methylsulfanylbutanoate	5255805	Click to see CSCCC(C(=O)[O-])[NH3+]	149.21	unknown	via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Phenylalanine and derivatives
(2R)-2-ammonio-3-phenylpropanoate	6919011	Click to see C1=CC=C(C=C1)CC(C(=O)[O-])[NH3+]	165.19	unknown	via CMAUP database
L-Phenylalanine, 23	57397115	Click to see	165.19	unknown	via CMAUP database
Phenylalanine	6140	Click to see C1=CC=C(C=C1)CC(C(=O)O)N	165.19	unknown	via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Proline and derivatives
(2S)-pyrrolidinium-2-carboxylate	6971047	Click to see	115.13	unknown	via CMAUP database
> 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	via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Tyrosine and derivatives
(2R)-2-ammonio-3-(4-hydroxyphenyl)propanoate	6919035	Click to see	181.19	unknown	via CMAUP database
(2S)-2-ammonio-3-(4-hydroxyphenyl)propanoate	6942100	Click to see C1=CC(=CC=C1CC(C(=O)[O-])[NH3+])O	181.19	unknown	via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Valine and derivatives
(2S)-2-(15N)azanyl-4,4,4-trideuterio-3-methylbutanoic acid	11829420	Click to see	121.16	unknown	via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Amino acids and derivatives / Beta amino acids and derivatives
(3R)-3-azaniumylbutanoate	6994717	Click to see	103.12	unknown	via CMAUP database
(3S)-3-azaniumyl-3-phenylpropanoate	6921435	Click to see	165.19	unknown	via CMAUP database
3-Aminobutanoic acid	10932	Click to see CC(CC(=O)O)N	103.12	unknown	via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Amino acids and derivatives / Gamma amino acids and derivatives
4-Ammoniobutanoate	6992099	Click to see	103.12	unknown	via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Peptides / Oligopeptides
(2S)-N-[(1S)-1-[[(1S)-1-(acetylcarbamoyl)-4-guanidino-butyl]carbamoyl]-4-guanidino-butyl]-5-guanidino-2-[[(2S)-5-guanidino-2-[[(2S)-5-guanidino-2-[[(2S)-5-guanidino-2-[[(2S)-5-guanidino-2-[[(2S)-5-guanidino-2-[[(2S)-5-guanidino-2-hydroxy-pentanoyl]amino]pentanoyl]amino]pentanoyl]amino]pentanoyl]amino]pentanoyl]amino]pentanoyl]amino]pentanamide	49769220	Click to see	1465.70	unknown	via CMAUP database
> Organic acids and derivatives / Keto acids and derivatives / Beta-keto acids and derivatives
CID 54732694	54732694	Click to see	114.08	unknown	via CMAUP database
> Organic nitrogen compounds / Organonitrogen compounds / Quaternary ammonium salts / Cholines
(1,1,2,2-Tetradeuterio-2-hydroxy-ethyl)-tris(trideuteriomethyl)ammonium	10884620	Click to see	117.25	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Quinic acids and derivatives
(1S,3R,4R,5R)-3-[3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]-1,4,5-trihydroxy-cyclohexanecarboxylic acid	9476	Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O	354.31	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides
(Z)-Coniferin	91895380	Click to see COC1=C(C=CC(=C1)C=CCO)OC2C(C(C(C(O2)CO)O)O)O	342.34	unknown	via CMAUP database
Coniferin	5280372	Click to see COC1=C(C=CC(=C1)C=CCO)OC2C(C(C(C(O2)CO)O)O)O	342.34	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Aryl-aldehydes
5-Hydroxymethylfurfural	237332	Click to see C1=C(OC(=C1)C=O)CO	126.11	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Medium-chain aldehydes
2,4-Decadienal	5283349	Click to see	152.23	unknown	via CMAUP database
Deca-2,4-dienal	16899	Click to see	152.23	unknown	via CMAUP database
Decanal	8175	Click to see	156.26	unknown	via CMAUP database
Heptanal	8130	Click to see	114.19	unknown	via CMAUP database
Hexanal	6184	Click to see	100.16	unknown	via CMAUP database
Nonanal	31289	Click to see CCCCCCCCC=O	142.24	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Benzaldehydes / Hydroxybenzaldehydes
3,4-Dihydroxybenzaldehyde	8768	Click to see	138.12	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Cyclic ketones
Spiro(4.5)decan-2-one	557153	Click to see C1CCC2(CC1)CCC(=O)C2	152.23	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Cyclic ketones / Cyclohexenones
Isophorone	6544	Click to see	138.21	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones
2-Dodecanone	22556	Click to see	184.32	unknown	via CMAUP database
2-Undecanone	8163	Click to see	170.29	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Phenylketones / Alkyl-phenylketones
beta-Oxoacteoside	90470164	Click to see CC1C(C(C(C(O1)OC2C(C(OC(C2OC(=O)C=CC3=CC(=C(C=C3)O)O)CO)OCC(=O)C4=CC(=C(C=C4)O)O)O)O)O)O	638.60	unknown	via CMAUP database
Paeonol	11092	Click to see CC(=O)C1=C(C=C(C=C1)OC)O	166.17	unknown	via CMAUP database
> Organoheterocyclic compounds / Azaspirodecane derivatives
(5S,9R,13R,16S)-N,6,13-trimethyl-7-azapentacyclo[10.8.0.02,9.05,9.013,18]icos-18-en-16-amine	5316046	Click to see CC1C2CCC3C2(CCC4C3CC=C5C4(CCC(C5)NC)C)CN1	328.50	unknown	via CMAUP database
> Organoheterocyclic compounds / Benzodioxoles
Safrole	5144	Click to see	162.18	unknown	via CMAUP database
> Organoheterocyclic compounds / Benzofurans
(+)-Dill ether	12125546	Click to see CC1COC2C1CCC(=C2)C	152.23	unknown	via CMAUP database
3,6-Dimethyl-2,3,3a,4,5,7a-hexahydro-1-benzofuran	586292	Click to see CC1COC2C1CCC(=C2)C	152.23	unknown	via CMAUP database
4,7-Dimethylbenzofuran	33109	Click to see	146.19	unknown	via CMAUP database
Anethofuran	126537	Click to see	152.23	unknown	via CMAUP database
> Organoheterocyclic compounds / Diazines / Pyrazines
Tetramethylpyrazine	14296	Click to see	136.19	unknown	via CMAUP database
Trimethylpyrazine	26808	Click to see	122.17	unknown	via CMAUP database
> Organoheterocyclic compounds / Heteroaromatic compounds
2-Pentylfuran	19602	Click to see	138.21	unknown	via CMAUP database
> Organoheterocyclic compounds / Imidazopyrimidines / Purines and purine derivatives / 6-aminopurines
Adenine	190	Click to see C1=NC2=NC=NC(=C2N1)N	135.13	unknown	via CMAUP database
> Organoheterocyclic compounds / Indoles and derivatives / Indolyl carboxylic acids and derivatives
(2S)-2-ammonio-3-(1H-indol-3-yl)propanoate	6923516	Click to see	204.22	unknown	via CMAUP database
D-Tryptophan	9060	Click to see	204.22	unknown	via CMAUP database
> Organoheterocyclic compounds / Isobenzofurans
(E)-3-Butylidene-4,5-dihydroisobenzofuran-1(3H)-one	5877292	Click to see	190.24	unknown	via CMAUP database
Ligustilide	5319022	Click to see	190.24	unknown	via CMAUP database
> Organoheterocyclic compounds / Isoquinolines and derivatives / Benzylisoquinolines
4-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-[4-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]phenoxy]phenol	45358120	Click to see	624.80	unknown	via CMAUP database
> Organoheterocyclic compounds / Pyridines and derivatives / Pyridinecarboxylic acids and derivatives / Pyridinecarboxamides / Nicotinamides
Nicotinamide	936	Click to see C1=CC(=CN=C1)C(=O)N	122.12	unknown	via CMAUP database
> Organoheterocyclic compounds / Pyridines and derivatives / Pyridinecarboxylic acids and derivatives / Pyridinecarboxylic acids
1-Methylpyridinium-3-carboxylate hydrochloride	6419886	Click to see C[N+]1=CC=CC(=C1)C(=O)[O-].Cl	173.60	unknown	via CMAUP database
> Organoheterocyclic compounds / Pyridopyrimidines / Pyrido[2,3-d]pyrimidines
Pyrido(2,3-d)pyrimidine	582898	Click to see C1=CC2=CN=CN=C2N=C1	131.13	unknown	via CMAUP database
> Organoheterocyclic compounds / Pyrrolidines / N-acylpyrrolidines
Pyrrolidine, 1-(1-oxo-7,10-hexadecadienyl)-	5370371	Click to see CCCCCC=CCC=CCCCCCC(=O)N1CCCC1	305.50	unknown	via CMAUP database
> Phenylpropanoids and polyketides / 2-arylbenzofuran flavonoids
(-)-Dehydrodiconiferyl Alcohol	11078843	Click to see COC1=CC(=CC2=C1OC(C2CO)C3=CC(=C(C=C3)O)OC)C=CCO	358.40	unknown	via CMAUP database
(+)-Dehydrodiconiferyl Alcohol	11824478	Click to see	358.40	unknown	via CMAUP database
Dehydrodiconiferyl alcohol	5372367	Click to see	358.40	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Cinnamaldehydes
Cinnamaldehyde	637511	Click to see	132.16	unknown	via CMAUP database
cis-Cinnamaldehyde	6428995	Click to see	132.16	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives
[(2R,3R,4R,5R,6R)-6-[(2R)-2-(3,4-dihydroxyphenyl)-2-hydroxyethoxy]-5-hydroxy-2-(hydroxymethyl)-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate	102000758	Click to see CC1C(C(C(C(O1)OC2C(C(OC(C2OC(=O)C=CC3=CC(=C(C=C3)O)O)CO)OCC(C4=CC(=C(C=C4)O)O)O)O)O)O)O	640.60	unknown	via CMAUP database
Isoacteoside	6476333	Click to see CC1C(C(C(C(O1)OC2C(C(OC(C2O)OCCC3=CC(=C(C=C3)O)O)COC(=O)C=CC4=CC(=C(C=C4)O)O)O)O)O)O	624.60	unknown	via CMAUP database
Verbascoside	5281800	Click to see CC1C(C(C(C(O1)OC2C(C(OC(C2OC(=O)C=CC3=CC(=C(C=C3)O)O)CO)OCCC4=CC(=C(C=C4)O)O)O)O)O)O	624.60	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids
3-(3,4-Dihydroxyphenyl)Prop-2-Enoic Acid	2518	Click to see	180.16	unknown	via CMAUP database
Ferulic Acid	445858	Click to see	194.18	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Cinnamyl alcohols
Caffeyl alcohol	5282096	Click to see C1=CC(=C(C=C1C=CCO)O)O	166.17	unknown	via CMAUP database
p-Coumaryl alcohol	5280535	Click to see	150.17	unknown	via CMAUP database
p-Coumaryl alcohol, (Z)-	12641150	Click to see	150.17	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Tannins / Hydrolyzable tannins
Protocatechuic acid 3-glucoside	11972438	Click to see C1=CC(=C(C=C1C(=O)O)OC2C(C(C(C(O2)CO)O)O)O)O	316.26	unknown	via CMAUP database

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Pinellia ternata

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