Isodon japonicus

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Synonyms

Common Names

Subtypes (subspecies, varieties, subvarieties, forms)

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Distribution

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Genome

Scientific Literature

Phytochemical Profile

Biological Material

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Details Top

Internal ID	UUID643fdf7e316e5345669354
Scientific name	Isodon japonicus
Authority	(Burm.f.) H.Hara
First published in	Enum. Spermatophytarum Japon. 1: 206 (1948)

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Synonyms Top

Scientific name	Authority	First published in
Plectranthus japonicus	Koidz.	Bot. Mag. (Tokyo) 43: 386 (1929)
Rabdosia japonica	(Burm.f.) H.Hara	J. Jap. Bot. 47: 196 (1972)
Scutellaria japonica	Burm.f.	Fl. Indica : 130 (1768)
Isodon glaucocalyx var. japonicus	(Burm.f.) Kudô	Mem. Fac. Sci. Taihoku Imp. Univ. 2: 127. 1929
Amethystanthus japonicus	(Burm.f.) Nakai	Bot. Mag. (Tokyo) 48: 788 (1934)
Amethystanthus japonicus f. albidus	Honda	Bot. Mag. (Tokyo) 54: 4 1940
Amethystanthus japonicus var. albiflorus	Honda	Bot. Mag. (Tokyo) 54: 4. 1940
Plectranthus glaucocalyx var. japonicus	(Burm.f.) Maxim.

Common names Top

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Language	Common/alternative name
Japanese	ヒキオコシ
Korean	방아풀
Chinese	毛叶香茶菜

Subspecies (abbr. subsp./ssp.) Top

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Varieties (abbr. var.) Top

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Name	Authority	First published in
Isodon japonicus var. glaucocalyx	(Maxim.) H.W.Li	J. Arnold Arbor. 69: 307 (1988)
Isodon japonicus var. japonicus		Unknown

Subvarieties (abbr. subvar.) Top

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Forms (abbr. f.) Top

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Germination/Propagation Top

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No germination or propagation data was added yet.

Distribution (via POWO/KEW) Top

Legend for the distribution data:

- Doubtful data

- Extinct

- Introduced

- Native

Asia-temperate click to expand
- China
  - China North-central
  - China South-central
  - Manchuria
- Eastern Asia
  - Japan
  - Korea
- Russian Far East
  - Amur
  - Khabarovsk
  - Primorye

Asia-tropical click to expand
- Indian Subcontinent
  - India
  - West Himalaya

Links to other databases Top

Suggest others/fix!

Database	ID/link to page
World Flora Online	wfo-0000217877
Tropicos	17607178
KEW	urn:lsid:ipni.org:names:448584-1
The Plant List	kew-102949
PFAF	Isodon japonicus
Open Tree Of Life	76005
NCBI Taxonomy	425908
IPNI	448584-1
iNaturalist	776877
GBIF	7308617
Freebase	/m/0nbdv6h
EOL	2898957
CMAUP	NPO26266

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

The complete chloroplast genome of Orthosiphon aristatus (Blume) Miq. (Lamiaceae)

Su Y, Li B, Liang W, Wen H, Wei W

Mitochondrial DNA B Resour

11-Jan-2024

PMCID:	PMC10786424
doi:	10.1080/23802359.2023.2301012
PMID:	38222982

The complete chloroplast genome sequence of Plectranthus hadiensis (Lamiaceae) and phylogenetic analysis

Hao J, Lu Y, Dang M, Xia R, Xu L, Zhu Z, Yu Y

Mitochondrial DNA B Resour

05-Oct-2023

PMCID:	PMC10557565
doi:	10.1080/23802359.2023.2262689
PMID:	37810612

Editorial: RNA recognition landscapes and anticancer drug targeting

Salvati E, Lewinska A, Dassi E, Wnuk M, D’Agostino VG

Front Oncol

19-Jun-2023

PMCID:	PMC10315894
doi:	10.3389/fonc.2023.1222883
PMID:	37404766

Application of Rosmarinic Acid with Its Derivatives in the Treatment of Microbial Pathogens

Kernou ON, Azzouz Z, Madani K, Rijo P

Molecules

22-May-2023

PMCID:	PMC10220798
doi:	10.3390/molecules28104243
PMID:	37241981

Lavandula austroapennina (Lamiaceae): Getting Insights into Bioactive Polyphenols of a Rare Italian Endemic Vascular Plant

Gravina C, Formato M, Piccolella S, Fiorentino M, Stinca A, Pacifico S, Esposito A

Int J Mol Sci

28-Apr-2023

PMCID:	PMC10178519
doi:	10.3390/ijms24098038
PMID:	37175744

In vitro and in silico studies of 7′′,8′′-buddlenol D anti-inflammatory lignans from Carallia brachiata as p38 MAP kinase inhibitors

Nalinratana N, Suriya U, Laprasert C, Wisidsri N, Poldorn P, Rungrotmongkol T, Limpanasitthikul W, Wu HC, Chang HS, Chansriniyom C

Sci Rep

02-Mar-2023

PMCID:	PMC9981598
doi:	10.1038/s41598-023-30475-5
PMID:	36864126

Small Molecule EGFR Inhibitors as Anti-Cancer Agents: Discovery, Mechanisms of Action, and Opportunities

Zubair T, Bandyopadhyay D

Int J Mol Sci

31-Jan-2023

PMCID:	PMC9916655
doi:	10.3390/ijms24032651
PMID:	36768973

Characterization of the complete chloroplast genome sequence of Isodon japonicus (N. Burman) H. Hara (Lamiaceae)

Wang H, Wang Y, Lu Y, Zhu S, Huang J, Yue C

Mitochondrial DNA B Resour

23-Sep-2022

PMCID:	PMC9518240
doi:	10.1080/23802359.2022.2123718
PMID:	36188661

The Impact of Oxidative Stress and AKT Pathway on Cancer Cell Functions and Its Application to Natural Products

Shiau JP, Chuang YT, Tang JY, Yang KH, Chang FR, Hou MF, Yen CY, Chang HW

Antioxidants (Basel)

19-Sep-2022

PMCID:	PMC9495789
doi:	10.3390/antiox11091845
PMID:	36139919

New Diterpenes with Potential Antitumoral Activity Isolated from Plants in the Years 2017–2022

Forzato C, Nitti P

Plants (Basel)

29-Aug-2022

PMCID:	PMC9460660
doi:	10.3390/plants11172240
PMID:	36079622

Traditional Chinese medicine: An important source for discovering candidate agents against hepatic fibrosis

Li WQ, Liu WH, Qian D, Liu J, Zhou SQ, Zhang L, Peng W, Su L, Zhang H

Front Pharmacol

23-Aug-2022

PMCID:	PMC9445813
doi:	10.3389/fphar.2022.962525
PMID:	36081936

Glaucocalyxin A Inhibits the Malignant Progression of Epithelial Ovarian Cancer by Affecting the MicroRNA-374b-5p/HMGB3/Wnt-β-Catenin Pathway Axis

Chen F, Sun F, Liu X, Shao J, Zhang B

Front Oncol

14-Jul-2022

PMCID:	PMC9329791
doi:	10.3389/fonc.2022.955830
PMID:	35912216

Medicinal Plants for the Treatment of Gastrointestinal Cancers From the Metabolomics Perspective

Guo W, Cao P, Wang X, Hu M, Feng Y

Front Pharmacol

27-Jun-2022

PMCID:	PMC9271783
doi:	10.3389/fphar.2022.909755
PMID:	35833022

Natural Therapeutics in Aid of Treating Alzheimer’s Disease: A Green Gateway Toward Ending Quest for Treating Neurological Disorders

Bhat BA, Almilaibary A, Mir RA, Aljarallah BM, Mir WR, Ahmad F, Mir MA

Front Neurosci

16-May-2022

PMCID:	PMC9149276
doi:	10.3389/fnins.2022.884345
PMID:	35651632

Unravelling the Therapeutic Potential of Botanicals Against Chronic Obstructive Pulmonary Disease (COPD): Molecular Insights and Future Perspectives

Mitra S, Anand U, Ghorai M, Vellingiri B, Jha NK, Behl T, Kumar M, Radha, Shekhawat MS, Proćków J, Dey A

Front Pharmacol

11-May-2022

PMCID:	PMC9130824
doi:	10.3389/fphar.2022.824132
PMID:	35645819

Phytochemical Profile Top

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Below are displayed the proven (via scientific papers) natural compounds!
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Name	PubChem ID	Canonical SMILES	MW	Found in	Proof
> Alkaloids and derivatives / Cytochalasans
Cytochalasin Z5	21574192	Click to see CC1CCCC(C=CC(=O)OC23C(C=CC1)C(C(=C)C(C2C(NC3=O)CC4=CC=C(C=C4)O)C)O)O	495.60	unknown	via CMAUP database
> Alkaloids and derivatives / Cytochalasans / Cytochalasins
Cytochalasin a	5458383	Click to see CC1CCCC(=O)C=CC(=O)OC23C(C=CC1)C(C(=C)C(C2C(NC3=O)CC4=CC=CC=C4)C)O	477.60	unknown	via CMAUP database
Cytochalasin B	5311281	Click to see CC1CCCC(C=CC(=O)OC23C(C=CC1)C(C(=C)C(C2C(NC3=O)CC4=CC=CC=C4)C)O)O	479.60	unknown	via CMAUP database
Cytochalasin F	21672263	Click to see CC1CCCC(C=CC(=O)OC23C(C=CC1)C4C(O4)(C(C2C(NC3=O)CC5=CC=CC=C5)C)C)O	479.60	unknown	via CMAUP database
Cytochalasin Z4	21574191	Click to see CC1CCCC(C=CC(=O)OC23C(C=CC1)C(C(=C)C(C2C(NC3=O)CC4=CC=CC=C4O)C)O)O	495.60	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives
Phenylethyl Alcohol	6054	Click to see C1=CC=C(C=C1)CCO	122.16	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acid esters
cis-3-Hexenyl benzoate	5367706	Click to see CCC=CCCOC(=O)C1=CC=CC=C1	204.26	unknown	via CMAUP database
Ethyl benzoate	7165	Click to see CCOC(=O)C1=CC=CC=C1	150.17	unknown	via CMAUP database
Hexyl benzoate	23235	Click to see CCCCCCOC(=O)C1=CC=CC=C1	206.28	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acids
Benzoic Acid	243	Click to see C1=CC=C(C=C1)C(=O)O	122.12	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives / Gallic acids
Gallic Acid	370	Click to see C1=C(C=C(C(=C1O)O)O)C(=O)O	170.12	unknown	https://doi.org/10.1271/BBB.59.1780
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / M-methoxybenzoic acids and derivatives
Vanillic Acid	8468	Click to see COC1=C(C=CC(=C1)C(=O)O)O	168.15	unknown	https://doi.org/10.1271/BBB.59.1780
> Benzenoids / Benzene and substituted derivatives / Benzoyl derivatives
Benzaldehyde	240	Click to see C1=CC=C(C=C1)C=O	106.12	unknown	via CMAUP database
p-Anisaldehyde	31244	Click to see COC1=CC=C(C=C1)C=O	136.15	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzyl alcohols
Benzyl Alcohol	244	Click to see C1=CC=C(C=C1)CO	108.14	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzyloxycarbonyls
Benzyl acetate	8785	Click to see CC(=O)OCC1=CC=CC=C1	150.17	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Biphenyls and derivatives
2-Phenylphenol	7017	Click to see C1=CC=C(C=C1)C2=CC=CC=C2O	170.21	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Phenylpropanes
2-(4-Methylphenyl)propan-2-ol	14529	Click to see CC1=CC=C(C=C1)C(C)(C)O	150.22	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Styrenes
Styrene	7501	Click to see C=CC1=CC=CC=C1	104.15	unknown	via CMAUP database
> Benzenoids / Phenols / 1-hydroxy-4-unsubstituted benzenoids
Hydron;phenoxide	20488062	Click to see [H+].C1=CC=C(C=C1)[O-]	94.11	unknown	via CMAUP database
> Benzenoids / Phenols / Benzenediols / Hydroquinones
Hydroquinone	785	Click to see C1=CC(=CC=C1O)O	110.11	unknown	via CMAUP database
> Lignans, neolignans and related compounds / Aryltetralin lignans
Rabdosiin	471121	Click to see C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C2C(C3=CC(=C(C=C3C=C2C(=O)OC(CC4=CC(=C(C=C4)O)O)C(=O)O)O)O)C5=CC(=C(C=C5)O)O)O)O	718.60	unknown	https://doi.org/10.1016/S0031-9422(00)98002-6 https://doi.org/10.1248/CPB.36.3223
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters / Fatty acid methyl esters
Methyl palmitate	8181	Click to see CCCCCCCCCCCCCCCC(=O)OC	270.50	unknown	via CMAUP database
Methyl Stearate	8201	Click to see CCCCCCCCCCCCCCCCCC(=O)OC	298.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Branched fatty acids / Methyl-branched fatty acids
(R)-2-Methylbutanoic acid	6950479	Click to see CCC(C)C(=O)O	102.13	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols
(3R)-oct-1-en-3-ol	6992244	Click to see CCCCCC(C=C)O	128.21	unknown	via CMAUP database
1-Hexanol	8103	Click to see CCCCCCO	102.17	unknown	via CMAUP database
1-Octanol	957	Click to see CCCCCCCCO	130.23	unknown	via CMAUP database
cis-3-Hexen-1-ol	5281167	Click to see CCC=CCCO	100.16	unknown	via CMAUP database
Nonan-1-ol	8914	Click to see CCCCCCCCCO	144.25	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Kaurane diterpenoids
(15-Acetyloxy-9,10-dihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl)methyl acetate	75052573	Click to see CC(=O)OCC1(CCC(C23C1C(C(C45C2CCC(C4)C(=C)C5=O)(OC3)O)O)OC(=O)C)C	448.50	unknown	https://doi.org/10.1021/NP1004328 https://doi.org/10.1021/NP0705965
(15-Acetyloxy-9,10,18-trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl)methyl acetate	74349072	Click to see CC(=O)OCC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)OC(=O)C)C	464.50	unknown	https://doi.org/10.1021/NP0705965
(16-Hydroxy-5,5,9-trimethyl-14-methylidene-6,15-dioxo-2-tetracyclo[11.2.1.01,10.04,9]hexadecanyl) acetate	74948513	Click to see CC(=O)OC1CC2C(C(=O)CCC2(C3C14C(C(CC3)C(=C)C4=O)O)C)(C)C	374.50	unknown	https://doi.org/10.1016/0031-9422(92)90064-W https://doi.org/10.1016/0031-9422(92)80450-S
(1R,2R,4R,8S,9R,10S,13R)-2,8,16-trihydroxy-9-(hydroxymethyl)-5,5-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecan-15-one	146014674	Click to see CC1(CCC(C2(C1CC(C34C2CCC(C3O)C(=C)C4=O)O)CO)O)C	350.40	unknown	https://doi.org/10.1055/S-2001-15808
(1R,2R,4R,8S,9R,10S,13S,16R)-2,8,16-trihydroxy-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.0^{1,10.0^{4,9]hexadecan-15-one	13945496	Click to see CC1(CCC(C2(C1CC(C34C2CCC(C3O)C(=C)C4=O)O)C)O)C	334.40	unknown	https://doi.org/10.1055/S-2001-15808
(1R,2R,4S,9R,10S,13S,14R,16R)-2,16-dihydroxy-5,5,9,14-tetramethyltetracyclo[11.2.1.01,10.04,9]hexadecane-6,15-dione	13919296	Click to see CC1C2CCC3C4(CCC(=O)C(C4CC(C3(C2O)C1=O)O)(C)C)C	334.40	unknown	https://doi.org/10.1016/0031-9422(92)90064-W https://doi.org/10.1016/0031-9422(92)80450-S
(1R,2R,4S,9S,10S,13S,15S,16R)-2,15,16-trihydroxy-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecan-6-one	162842245	Click to see CC1(C2CC(C34C(C2(CCC1=O)C)CCC(C3O)C(=C)C4O)O)C	334.40	unknown	https://doi.org/10.1016/0031-9422(92)90064-W https://doi.org/10.1016/0031-9422(92)80450-S
(1R,2S,5S,8R,9R,11R,15S,18S)-9,15,18-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one	162990881	Click to see CC1(CCC(C23C1CC(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)C	348.40	unknown	https://doi.org/10.1021/NP0705965
(1R,2S,5S,8R,9S,11R,15S,18R)-9,15,18-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one	10315734	Click to see CC1(CCC(C23C1CC(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)C	348.40	unknown	https://doi.org/10.1021/NP0705965
(1R,2S,5S,8R,9S,11S,13S,14S,15R,19S)-13,14,19-trihydroxy-16,16-dimethyl-6-methylidene-10,12-dioxahexacyclo[9.8.0.01,15.02,8.05,9.08,13]nonadecan-7-one	92484182	Click to see CC1(CCC(C23C1C(C4(C56C2CCC(C5OC3O4)C(=C)C6=O)O)O)O)C	362.40	unknown	https://doi.org/10.1016/S0040-4020(01)97055-3
(1R,3R,4S,8R,10S,11R,12R,13S,15R,17S)-3,17-dihydroxy-5,5-dimethyl-16-methylidene-9,19-dioxahexacyclo[13.2.1.110,13.01,12.04,11.08,11]nonadecan-2-one	162938931	Click to see CC1(CCC2C34C1C(C(=O)C56C3C(CC(C5)C(=C)C6O)OC4O2)O)C	346.40	unknown	https://doi.org/10.1055/S-2004-827165
(1R,4R,9R,10S)-2,8,12,16-tetrahydroxy-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecan-15-one	137795540	Click to see CC1(CCC(C2(C1CC(C34C2CC(C(C3O)C(=C)C4=O)O)O)C)O)C	350.40	unknown	https://doi.org/10.1055/S-2001-15808
(1S,2S,5S,8S,9R,11R,15S,16R,18R)-15,18-dihydroxy-16-methoxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one	162960861	Click to see CC1(CCC(C23C1CC(C45C2CCC(C4O)C(=C)C5=O)OC3OC)O)C	362.50	unknown	https://doi.org/10.1055/S-2001-15808
(1S,2S,8R,9S,11R)-9,10,15,18-tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one	138107787	Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)O)C	364.40	unknown	https://doi.org/10.1016/S0367-326X(03)00107-2 https://doi.org/10.1271/BBB1961.48.1647 https://doi.org/10.1016/0031-9422(89)80201-8 https://doi.org/10.1055/S-2002-32080 https://doi.org/10.1007/S11094-015-1200-5 https://doi.org/10.1039/J39700001674
(2-Hydroxy-5,5,9-trimethyl-14-methylidene-6,15-dioxo-16-tetracyclo[11.2.1.01,10.04,9]hexadecanyl) acetate	14193398	Click to see CC(=O)OC1C2CCC3C1(C(CC4C3(CCC(=O)C4(C)C)C)O)C(=O)C2=C	374.50	unknown	https://doi.org/10.1016/0031-9422(92)90064-W https://doi.org/10.1016/0031-9422(92)80450-S
(2S,5S,8R,13R,14S,15R)-13,14,19-trihydroxy-16,16-dimethyl-6-methylidene-10,12-dioxahexacyclo[9.8.0.01,15.02,8.05,9.08,13]nonadecan-7-one	5320676	Click to see CC1(CCC(C23C1C(C4(C56C2CCC(C5OC3O4)C(=C)C6=O)O)O)O)C	362.40	unknown	https://doi.org/10.1016/S0040-4020(01)97055-3
(3-Acetyloxy-9,10,15-trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl)methyl acetate	74349282	Click to see CC(=O)OCC1(CCC(C23C1C(C(C45C2C(CC(C4)C(=C)C5=O)OC(=O)C)(OC3)O)O)O)C	464.50	unknown	https://doi.org/10.1021/NP0705965
(3,9,10-Trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl)methyl acetate	14395564	Click to see CC(=O)OCC1(CCCC23C1C(C(C45C2C(CC(C4)C(=C)C5=O)O)(OC3)O)O)C	406.50	unknown	https://doi.org/10.1021/NP0705965 https://doi.org/10.1021/NP200140J
(7,9,10,15-Tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-3-yl) acetate	14109082	Click to see CC(=O)OC1CC2CC3(C1C45COC3(C(C4C(CCC5O)(C)C)O)O)C(C2=C)O	408.50	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2004.02.022
(9,10-Dihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl)methyl acetate	75052823	Click to see CC(=O)OCC1(CCCC23C1C(C(C45C2CCC(C4)C(=C)C5=O)(OC3)O)O)C	390.50	unknown	https://doi.org/10.1021/NP1004328 https://doi.org/10.1021/NP0705965
(9,10,15-Trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl)methyl acetate	75052824	Click to see CC(=O)OCC1(CCC(C23C1C(C(C45C2CCC(C4)C(=C)C5=O)(OC3)O)O)O)C	406.50	unknown	https://doi.org/10.1021/NP1004328 https://doi.org/10.1021/NP0705965
(9,10,18-Trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl)methyl acetate	457901	Click to see CC(=O)OCC1(CCCC23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)C	406.50	unknown	https://doi.org/10.1021/NP0705965
(9,10,18-Trihydroxy-12,12-dimethyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-15-yl) acetate	429192	Click to see CC(=O)OC1CCC(C2C13COC(C2O)(C45C3CCC(C4O)C(=C)C5=O)O)(C)C	406.50	unknown	https://doi.org/10.1021/NP0705965
[(1R,1'R,2'R,4'S,5S,6S,9R)-4'-acetyloxy-2'-(hydroxymethyl)-1'-methyl-10-methylidene-11-oxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,3'-cyclohexane]-1'-yl]methyl acetate	44586016	Click to see CC(=O)OCC1(CCC(C2(C1CO)COCC34C2CCC(C3)C(=C)C4=O)OC(=O)C)C	434.50	unknown	https://doi.org/10.1021/NP0705965
[(1R,2R,4R,8S,9R,10S,12S,13S,16R)-2,8,16-trihydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-12-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate	13193213	Click to see CC(=O)OC1CC2C3(C(CCC(C3CC(C24C(C1C(=C)C4=O)O)O)(C)C)O)C	392.50	unknown	https://doi.org/10.1021/NP0705965
[(1R,2R,4S,6S,9R,10S,13S,16S)-2,16-dihydroxy-5,5,9-trimethyl-14-methylidene-12,15-dioxo-6-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate	162882922	Click to see CC(=O)OC1CCC2(C(C1(C)C)CC(C34C2CC(=O)C(C3O)C(=C)C4=O)O)C	390.50	unknown	https://doi.org/10.1021/NP0705965
[(1R,2S,3R,5R,8S,9S,10S,11R,12R)-3,9,10-trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate	70697969	Click to see CC(=O)OCC1(CCCC23C1C(C(C45C2C(CC(C4)C(=C)C5=O)O)(OC3)O)O)C	406.50	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2017.08.009
[(1R,2S,3R,5S,7R,8S,9S,10S,11R,15S)-7,9,10,15-tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-3-yl] acetate	163092042	Click to see CC(=O)OC1CC2CC3(C1C45COC3(C(C4C(CCC5O)(C)C)O)O)C(C2=C)O	408.50	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2004.02.022
[(1R,2S,3R,5S,8S,9R,10S,11R,12R,15S)-3-acetyloxy-9,10,15-trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate	44586015	Click to see CC(=O)OCC1(CCC(C23C1C(C(C45C2C(CC(C4)C(=C)C5=O)OC(=O)C)(OC3)O)O)O)C	464.50	unknown	https://doi.org/10.1021/NP0705965
[(1R,2S,3R,5S,8S,9R,10S,11R,12R)-3,9,10-trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate	44445755	Click to see CC(=O)OCC1(CCCC23C1C(C(C45C2C(CC(C4)C(=C)C5=O)O)(OC3)O)O)C	406.50	unknown	https://doi.org/10.1021/NP0705965
[(1R,2S,3R,5S,8S,9S,10S,11R,12R,15S)-3-acetyloxy-9,10,15-trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate	24900166	Click to see CC(=O)OCC1(CCC(C23C1C(C(C45C2C(CC(C4)C(=C)C5=O)OC(=O)C)(OC3)O)O)O)C	464.50	unknown	https://doi.org/10.1021/NP0705965
[(1R,2S,3R,5S,8S,9S,10S,11R,12R)-3,9,10-trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate	14395565	Click to see CC(=O)OCC1(CCCC23C1C(C(C45C2C(CC(C4)C(=C)C5=O)O)(OC3)O)O)C	406.50	unknown	https://doi.org/10.1021/NP0705965
[(1R,2S,5R,8S,9S,10S,11R,12R)-9,10-dihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate	102239739	Click to see CC(=O)OCC1(CCCC23C1C(C(C45C2CCC(C4)C(=C)C5=O)(OC3)O)O)C	390.50	unknown	https://doi.org/10.1021/NP0705965
[(1R,2S,5S,8R,9S,10S,11R,12R,18R)-9,10,18-trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate	162945693	Click to see CC(=O)OCC1(CCCC23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)C	406.50	unknown	https://doi.org/10.1021/NP0705965
[(1R,2S,8S,9R,10S,11R,12R)-9,10-dihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate	139031632	Click to see CC(=O)OCC1(CCCC23C1C(C(C45C2CCC(C4)C(=C)C5=O)(OC3)O)O)C	390.50	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2017.08.009
[(1R,4S,6R,9R,10S,11S,13R)-6,13-dihydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-11-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate	15109168	Click to see CC(=O)OC1CC2(CC3(C1C4(CCC(C(C4CC3)(C)C)O)C)C(=O)C2=C)O	376.50	unknown	https://doi.org/10.1055/S-2002-32080
[(1S,2R,4R,8S,9R,10S,12S,13R,16S)-2,8,16-trihydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-12-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate	162950367	Click to see CC(=O)OC1CC2C3(C(CCC(C3CC(C24C(C1C(=C)C4=O)O)O)(C)C)O)C	392.50	unknown	https://doi.org/10.1021/NP0705965
[(1S,2R,4S,9R,10S,13S,16R)-16-hydroxy-5,5,9-trimethyl-14-methylidene-6,15-dioxo-2-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate	15139537	Click to see CC(=O)OC1CC2C(C(=O)CCC2(C3C14C(C(CC3)C(=C)C4=O)O)C)(C)C	374.50	unknown	https://doi.org/10.1016/0031-9422(92)90064-W https://doi.org/10.1016/0031-9422(92)80450-S
[(1S,2R,8S,9S,11R)-7-acetyloxy-9-hydroxy-12,12-dimethyl-6-methylidene-15-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadec-13-en-10-yl] acetate	129316899	Click to see CC(=O)OC1C2C(C=CC(=O)C23COC1(C45C3CCC(C4)C(=C)C5OC(=O)C)O)(C)C	430.50	unknown	https://doi.org/10.1016/S0367-326X(03)00107-2
[(1S,2S,5R,10S,11R,15S,18R)-9,10,18-trihydroxy-12,12-dimethyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-15-yl] acetate	6325508	Click to see CC(=O)OC1CCC(C2C13COC(C2O)(C45C3CCC(C4O)C(=C)C5=O)O)(C)C	406.50	unknown	https://doi.org/10.1021/NP0705965
[(1S,2S,5R,6S,7S,8S,10S,11R,15R)-10-acetyloxy-6,7,9,15-tetrahydroxy-12,12-dimethyl-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-6-yl]methyl acetate	102004643	Click to see CC(=O)OCC1(C2CCC3C(C2)(C1O)C4(C(C5C3(CO4)C(CCC5(C)C)O)OC(=O)C)O)O	468.50	unknown	https://doi.org/10.1007/S11094-015-1200-5 https://doi.org/10.1016/S0367-326X(03)00107-2
[(1S,2S,5R,8S,9R,10S,11R,12R,15S)-9,10,15-trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate	73355983	Click to see CC(=O)OCC1(CCC(C23C1C(C(C45C2CCC(C4)C(=C)C5=O)(OC3)O)O)O)C	406.50	unknown	https://doi.org/10.1021/NP0705965
[(1S,2S,5R,8S,9S,10S,11R,12R,15S)-9,10,15-trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate	163083341	Click to see CC(=O)OCC1(CCC(C23C1C(C(C45C2CCC(C4)C(=C)C5=O)(OC3)O)O)O)C	406.50	unknown	https://doi.org/10.1021/NP0705965
[(1S,2S,5S,8R,9S,10S,11R,12R,15S,18R)-15-acetyloxy-9,10,18-trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate	24899414	Click to see CC(=O)OCC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)OC(=O)C)C	464.50	unknown	https://doi.org/10.1021/NP0705965
[(1S,2S,8S,9R,10S,11R,12R,15S)-15-acetyloxy-9,10-dihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate	139031633	Click to see CC(=O)OCC1(CCC(C23C1C(C(C45C2CCC(C4)C(=C)C5=O)(OC3)O)O)OC(=O)C)C	448.50	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2017.08.009
[(1S,4S,9S,10R)-2,8,16-trihydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-12-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate	137705109	Click to see CC(=O)OC1CC2C3(C(CCC(C3CC(C24C(C1C(=C)C4=O)O)O)(C)C)O)C	392.50	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2017.08.009
[(2S,5R,9S,10R,11R,12R,15S)-9,10,15-trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate	102239747	Click to see CC(=O)OCC1(CCC(C23C1C(C(C45C2CCC(C4)C(=C)C5=O)(OC3)O)O)O)C	406.50	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2017.08.009
[(2S,5S,9S,10R,11R,12R,18R)-9,10,18-trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate	102117145	Click to see CC(=O)OCC1(CCCC23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)C	406.50	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2017.08.009
[(2S,5S,9S,10R,11R,15R,18R)-9,10,18-trihydroxy-12,12-dimethyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-15-yl] acetate	101306857	Click to see CC(=O)OC1CCC(C2C13COC(C2O)(C45C3CCC(C4O)C(=C)C5=O)O)(C)C	406.50	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2017.08.009
[(2S,9R,10S,11R)-9,10,18-trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate	369902	Click to see CC(=O)OCC1(CCCC23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)C	406.50	unknown	https://doi.org/10.1021/NP0705965
[(5R,8S,9R,10S,12R,15R)-9,10,15-trihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate	5315341	Click to see CC(=O)OCC1(CCC(C23C1C(C(C45C2CCC(C4)C(=C)C5=O)(OC3)O)O)O)C	406.50	unknown	https://doi.org/10.1021/NP1004328
1,7,12,14-Tetrahydroxykaur-16-en-15-one (1alpha,7alpha,12alpha,14R)	174150	Click to see CC1(CCC(C2(C1CC(C34C2CC(C(C3O)C(=C)C4=O)O)O)C)O)C	350.40	unknown	https://doi.org/10.1055/S-2001-15808
15,18-Dihydroxy-16-methoxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one	13945517	Click to see CC1(CCC(C23C1CC(C45C2CCC(C4O)C(=C)C5=O)OC3OC)O)C	362.50	unknown	https://doi.org/10.1055/S-2001-15808
2,15,16-Trihydroxy-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecan-6-one	13919282	Click to see CC1(C2CC(C34C(C2(CCC1=O)C)CCC(C3O)C(=C)C4O)O)C	334.40	unknown	https://doi.org/10.1016/0031-9422(92)90064-W https://doi.org/10.1016/0031-9422(92)80450-S
2,16-Dihydroxy-5,5,9,14-tetramethyltetracyclo[11.2.1.01,10.04,9]hexadecane-6,15-dione	13919293	Click to see CC1C2CCC3C4(CCC(=O)C(C4CC(C3(C2O)C1=O)O)(C)C)C	334.40	unknown	https://doi.org/10.1016/0031-9422(92)90064-W https://doi.org/10.1016/0031-9422(92)80450-S
2,8,12,16-Tetrahydroxy-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecan-15-one	13193212	Click to see CC1(CCC(C2(C1CC(C34C2CC(C(C3O)C(=C)C4=O)O)O)C)O)C	350.40	unknown	https://doi.org/10.1055/S-2001-15808
3,17-Dihydroxy-5,5-dimethyl-16-methylidene-9,19-dioxahexacyclo[13.2.1.110,13.01,12.04,11.08,11]nonadecan-2-one	73074542	Click to see CC1(CCC2C34C1C(C(=O)C56C3C(CC(C5)C(=C)C6O)OC4O2)O)C	346.40	unknown	https://doi.org/10.1055/S-2004-827165
7,14-Dihydroxykaur-16-ene-3,15-dione	127626	Click to see CC1(C2CC(C34C(C2(CCC1=O)C)CCC(C3O)C(=C)C4=O)O)C	332.40	unknown	https://doi.org/10.1007/S11094-015-1200-5
9,10,15,18-Tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one	3576890	Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)O)C	364.40	unknown	https://doi.org/10.1021/NP0705965
CID 102587878	102587878	Click to see CC1(CCCC23C1C(C(C45C2C(CC(C4O)C(=C)C5=O)O)(OC3)O)O)C	364.40	unknown	https://doi.org/10.1016/0031-9422(89)80201-8
CID 196551	196551	Click to see CC(=O)OC1C2CCC3C1(C(CC4C3(CCC(=O)C4(C)C)C)O)C(=O)C2=C	374.50	unknown	https://doi.org/10.1007/S11094-015-1200-5
CID 3819	3819	Click to see CC1(CCC(C2(C1CC(C34C2CCC(C3O)C(=C)C4=O)O)CO)O)C	350.40	unknown	https://doi.org/10.1055/S-2001-15808
Effusanin D	44585547	Click to see CC(=O)OCC1(CCC(C23C1C(C(C45C2CCC(C4)C(=C)C5=O)(OC3)O)O)OC(=O)C)C	448.50	unknown	https://doi.org/10.1021/NP0705965
Excisanin A	11772488	Click to see CC1(CCC(C2(C1CC(C34C2CC(C(C3O)C(=C)C4=O)O)O)C)O)C	350.40	unknown	https://doi.org/10.1055/S-2001-15808
Excisanin B	367618	Click to see CC(=O)OC1CC2C3(C(CCC(C3CC(C24C(C1C(=C)C4=O)O)O)(C)C)O)C	392.50	unknown	https://doi.org/10.1021/NP0705965
Glaucocalyxin A	10471963	Click to see CC1(C2CC(C34C(C2(CCC1=O)C)CCC(C3O)C(=C)C4=O)O)C	332.40	unknown	https://doi.org/10.1016/0031-9422(92)90064-W https://doi.org/10.1016/0031-9422(92)80450-S https://doi.org/10.1007/S11094-015-1200-5 https://doi.org/10.1246/NIKKASHI.1985.799
Glaucocalyxin B	14193399	Click to see CC(=O)OC1C2CCC3C1(C(CC4C3(CCC(=O)C4(C)C)C)O)C(=O)C2=C	374.50	unknown	https://doi.org/10.1016/0031-9422(92)90064-W https://doi.org/10.1016/0031-9422(92)80450-S https://doi.org/10.1007/S11094-015-1200-5
Isodojaponin A	25023159	Click to see CC(=O)OCC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)OC(=O)C)C	464.50	unknown	https://doi.org/10.1021/NP0705965
Kamebakaurin	13945489	Click to see CC1(CCC(C2(C1CC(C34C2CCC(C3O)C(=C)C4=O)O)CO)O)C	350.40	unknown	https://doi.org/10.1055/S-2001-15808
Kamebanin	12004580	Click to see CC1(CCC(C2(C1CC(C34C2CCC(C3O)C(=C)C4=O)O)C)O)C	334.40	unknown	https://doi.org/10.1055/S-2001-15808
Kaur-16-en-15-one, 1-(acetyloxy)-7,20-epoxy-6,7,14-trihydroxy-, (1alpha,6beta,7alpha,14R)-	12305580	Click to see CC(=O)OC1CCC(C2C13COC(C2O)(C45C3CCC(C4O)C(=C)C5=O)O)(C)C	406.50	unknown	https://doi.org/10.1021/NP0705965
Lasiodin	73348360	Click to see CC(=O)OC1CCC(C2C13COC(C2O)(C45C3CCC(C4O)C(=C)C5=O)O)(C)C	406.50	unknown	https://doi.org/10.1021/NP0705965
LeukaMenin F; Wangzaozin B; Leucamenin F	14193397	Click to see CC1(C2CC(C34C(C2(CCC1=O)C)CCC(C3O)C(=C)C4=O)O)C	332.40	unknown	https://doi.org/10.1016/0031-9422(92)90064-W https://doi.org/10.1016/0031-9422(92)80450-S
Longikaurin B	10046926	Click to see CC(=O)OCC1(CCCC23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)C	406.50	unknown	https://doi.org/10.1021/NP0705965
longikaurin C	44586034	Click to see CC(=O)OCC1(CCCC23C1C(C(C45C2CCC(C4)C(=C)C5=O)(OC3)O)O)C	390.50	unknown	https://doi.org/10.1021/NP0705965
Megathyrin A	6712362	Click to see CC1(CCC(C23C1CC(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)C	348.40	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2017.08.009
Oridonin	5321010	Click to see CC1(CCC(C23C1C(C(C45C2CCC(C4O)C(=C)C5=O)(OC3)O)O)O)C	364.40	unknown	https://doi.org/10.1021/NP0705965 https://doi.org/10.1016/S0040-4020(01)97055-3
Ponicidin	14564539	Click to see CC1(CCC(C23C1C(C4(C56C2CCC(C5OC3O4)C(=C)C6=O)O)O)O)C	362.40	unknown	https://doi.org/10.1021/NP200140J
Pseurata C	14756333	Click to see CC(=O)OC1CCC2(C(C1(C)C)CC(C34C2CC(=O)C(C3O)C(=C)C4=O)O)C	390.50	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2017.08.009 https://doi.org/10.1021/NP0705965
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids
Linalool, (+)-	67179	Click to see CC(=CCCC(C)(C=C)O)C	154.25	unknown	via CMAUP database
Myrcene	31253	Click to see CC(=CCCC(=C)C=C)C	136.23	unknown	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
Carvacrol	10364	Click to see CC1=C(C=C(C=C1)C(C)C)O	150.22	unknown	via CMAUP database
p-CYMENE	7463	Click to see CC1=CC=C(C=C1)C(C)C	134.22	unknown	via CMAUP database
Thymol	6989	Click to see CC1=CC(=C(C=C1)C(C)C)O	150.22	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids
(-)-beta-Pinene	440967	Click to see CC1(C2CCC(=C)C1C2)C	136.23	unknown	via CMAUP database
(-)-Camphene	440966	Click to see CC1(C2CCC(C2)C1=C)C	136.23	unknown	via CMAUP database
(-)-Verbenone	92874	Click to see CC1=CC(=O)C2CC1C2(C)C	150.22	unknown	via CMAUP database
(+)-3-Carene	443156	Click to see CC1=CCC2C(C1)C2(C)C	136.23	unknown	via CMAUP database
(+)-alpha-Pinene	82227	Click to see CC1=CCC2CC1C2(C)C	136.23	unknown	via CMAUP database
Borneol, (-)-	1201518	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
Camphor (synthetic)	159055	Click to see CC1(C2CCC1(C(=O)C2)C)C	152.23	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Menthane monoterpenoids
(2S)-2-[(1R)-4-methylcyclohex-3-en-1-yl]propanal	76958477	Click to see CC1=CCC(CC1)C(C)C=O	152.23	unknown	via CMAUP database
[(4R)-4-(prop-1-en-2-yl)cyclohex-1-en-1-yl]methanol	11788398	Click to see CC(=C)C1CCC(=CC1)CO	152.23	unknown	via CMAUP database
Limonene, (+)-	440917	Click to see CC1=CCC(CC1)C(=C)C	136.23	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
(+)-delta-Cadinene	441005	Click to see CC1=CC2C(CCC(=C2CC1)C)C(C)C	204.35	unknown	via CMAUP database
alpha-Muurolene	12306047	Click to see CC1=CC2C(CC1)C(=CCC2C(C)C)C	204.35	unknown	via CMAUP database
Cuparene	86895	Click to see CC1=CC=C(C=C1)C2(CCCC2(C)C)C	202.33	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Trichothecenes
(1R,3R,8R,12E,17R,18E,20E,24R,25S,26S)-17-[(1R)-1-hydroxyethyl]-5-(hydroxymethyl)-13,25-dimethylspiro[2,10,16,23-tetraoxatetracyclo[22.2.1.03,8.08,25]heptacosa-4,12,18,20-tetraene-26,2'-oxirane]-11,22-dione	162999962	Click to see CC1=CC(=O)OCC23CCC(=CC2OC4CC(C3(C45CO5)C)OC(=O)C=CC=CC(OCC1)C(C)O)CO	530.60	unknown	https://doi.org/10.1021/NP50064A041 https://doi.org/10.1016/S0367-326X(03)00107-2
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones
Neriagenin	51040390	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC(=O)C3CCC4(C(CCC4O)C5=CC(=O)OC5)C)C)OC)OC6C(C(C(C(O6)CO)O)O)O	696.80	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Diterpene lactones
(17-Formyl-10,10-dimethyl-3-methylidene-8,15-dioxo-7,14-dioxapentacyclo[7.6.2.11,4.06,16.013,17]octadecan-2-yl) acetate	14287141	Click to see CC(=O)OC1C(=C)C2CC3C4C1(C2)C(=O)OC5C4(C(C(=O)O3)C(CC5)(C)C)C=O	402.40	unknown	https://doi.org/10.1016/0031-9422(89)80201-8
(1S,4R,6R,8R,9S,12R,13S,16R)-6,9-dihydroxy-7,7,17-trimethyl-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecane-2,18-dione	101588316	Click to see CC1C2CCC3C(C2)(C1=O)C(=O)OC4C35COC(C5C(C(C4)O)(C)C)O	364.40	unknown	https://doi.org/10.1016/S0031-9422(01)00245-X
(1S,4S,8R,12S,13S,16S)-9,14-dihydroxy-7,7-dimethyl-17-methylidene-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecane-2,18-dione	137705233	Click to see CC1(CCC2C3(C1C(OC3)O)C4C(CC5CC4(C(=O)C5=C)C(=O)O2)O)C	362.40	unknown	https://doi.org/10.1271/BBB1961.48.1647 https://doi.org/10.1016/S0031-9422(01)00245-X
(1S,4S,8R,9R,12S,13R,14S,16S)-9,14-dihydroxy-7,7-dimethyl-17-methylidene-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecane-2,18-dione	102004749	Click to see CC1(CCC2C3(C1C(OC3)O)C4C(CC5CC4(C(=O)C5=C)C(=O)O2)O)C	362.40	unknown	https://doi.org/10.1021/NP50064A041
(1S,4S,8R,9R,12S,13R,16R,17R)-9,14-dihydroxy-17-(methoxymethyl)-7,7-dimethyl-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecane-2,18-dione	101158592	Click to see CC1(CCC2C3(C1C(OC3)O)C4C(CC5CC4(C(=O)C5COC)C(=O)O2)O)C	394.50	unknown	https://doi.org/10.1016/S0031-9422(01)00245-X
(1S,4S,8R,9R,12S,13S,14S,16S,17S)-9,14-dihydroxy-17-(methoxymethyl)-7,7-dimethyl-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecane-2,18-dione	12967251	Click to see CC1(CCC2C3(C1C(OC3)O)C4C(CC5CC4(C(=O)C5COC)C(=O)O2)O)C	394.50	unknown	https://doi.org/10.1016/S0031-9422(01)00245-X
(1S,4S,8R,9R,12S,13S,14S,16S)-9-ethoxy-14-hydroxy-7,7-dimethyl-17-methylidene-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecane-2,18-dione	162980694	Click to see CCOC1C2C(CCC3C2(CO1)C4C(CC5CC4(C(=O)C5=C)C(=O)O3)O)(C)C	390.50	unknown	https://doi.org/10.1016/S0040-4020(01)97055-3
(4'-Acetyloxy-2'-formyl-1'-methyl-10-methylidene-2,11-dioxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,3'-cyclohexane]-1'-yl)methyl acetate	74349147	Click to see CC(=O)OCC1(CCC(C2(C1C=O)COC(=O)C34C2CCC(C3)C(=C)C4=O)OC(=O)C)C	446.50	unknown	https://doi.org/10.1021/NP0705965
(4'-Acetyloxy-2'-formyl-7-hydroxy-1'-methyl-10-methylidene-2,11-dioxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,3'-cyclohexane]-1'-yl)methyl acetate	3264386	Click to see CC(=O)OCC1(CCC(C2(C1C=O)COC(=O)C34C2C(CC(C3)C(=C)C4=O)O)OC(=O)C)C	462.50	unknown	https://doi.org/10.1021/NP0705965
(8-Formyl-11-hydroxy-7,7-dimethyl-14-methylidene-2,15-dioxo-3-oxatetracyclo[11.2.1.01,10.04,9]hexadecan-9-yl)methyl acetate	5088566	Click to see CC(=O)OCC12C(CCC(C1C=O)(C)C)OC(=O)C34C2C(CC(C3)C(=C)C4=O)O	404.50	unknown	https://doi.org/10.1271/BBB1961.48.1647 https://doi.org/10.1007/S11094-015-1200-5 https://doi.org/10.1016/S0040-4020(01)97055-3
(9-Hydroxy-7,7-dimethyl-17-methylidene-2,18-dioxo-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecan-6-yl) acetate	3459963	Click to see CC(=O)OC1CC2C3(COC(C3C1(C)C)O)C4CCC5CC4(C(=O)C5=C)C(=O)O2	404.50	unknown	https://doi.org/10.1016/S0040-4020(01)97055-3
[(1R,1'R,2'R,4'S,5S,6R,7R,9R)-4'-acetyloxy-2'-formyl-7-hydroxy-1'-methyl-10-methylidene-2,11-dioxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,3'-cyclohexane]-1'-yl]methyl acetate	163012346	Click to see CC(=O)OCC1(CCC(C2(C1C=O)COC(=O)C34C2C(CC(C3)C(=C)C4=O)O)OC(=O)C)C	462.50	unknown	https://doi.org/10.1021/NP0705965
[(1R,2S,4S,6R,9R,13S,16S,17S)-10,10,17-trimethyl-3-methylidene-8-oxo-7,14-dioxapentacyclo[7.6.2.11,4.06,16.013,17]octadecan-2-yl] acetate	101536713	Click to see CC(=O)OC1C(=C)C2CC3C4C1(C2)COC5C4(C(C(=O)O3)C(CC5)(C)C)C	374.50	unknown	https://doi.org/10.1016/0031-9422(89)80201-8 https://doi.org/10.1055/S-2002-32080
[(1R,4S,6S,8S,9R,12R,13S,14S,16R,17S)-9,14-dihydroxy-17-(methoxymethyl)-7,7-dimethyl-2,18-dioxo-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecan-6-yl] acetate	637391	Click to see CC(=O)OC1CC2C3(COC(C3C1(C)C)O)C4C(CC5CC4(C(=O)C5COC)C(=O)O2)O	452.50	unknown	https://doi.org/10.1016/S0031-9422(01)00245-X
[(1S,1'R,2'R,4'S,5S,6S,9R)-4'-acetyloxy-2'-(hydroxymethyl)-1'-methyl-10-methylidene-2,11-dioxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,3'-cyclohexane]-1'-yl]methyl acetate	24899661	Click to see CC(=O)OCC1(CCC(C2(C1CO)COC(=O)C34C2CCC(C3)C(=C)C4=O)OC(=O)C)C	448.50	unknown	https://doi.org/10.1021/NP0705965
[(1S,1'R,3'S,5R,6S,9S)-3',7,11-triacetyloxy-6',6'-dimethyl-10-methylidene-2-oxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,2'-cyclohexane]-1'-yl]methyl acetate	102041673	Click to see CC(=O)OCC1C(CCC(C12COC(=O)C34C2C(CC(C3)C(=C)C4OC(=O)C)OC(=O)C)OC(=O)C)(C)C	534.60	unknown	https://doi.org/10.1021/NP50064A041
[(1S,2R,4S,6S,9R,13S,16S,17R)-17-formyl-10,10-dimethyl-3-methylidene-8,15-dioxo-7,14-dioxapentacyclo[7.6.2.11,4.06,16.013,17]octadecan-2-yl] acetate	14287142	Click to see CC(=O)OC1C(=C)C2CC3C4C1(C2)C(=O)OC5C4(C(C(=O)O3)C(CC5)(C)C)C=O	402.40	unknown	https://doi.org/10.1016/0031-9422(89)80201-8
[(1S,4S,6S,8R,9R,12S,13S,14S,16S,17S)-9,14-dihydroxy-17-(methoxymethyl)-7,7-dimethyl-2,18-dioxo-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecan-6-yl] acetate	12967252	Click to see CC(=O)OC1CC2C3(COC(C3C1(C)C)O)C4C(CC5CC4(C(=O)C5COC)C(=O)O2)O	452.50	unknown	https://doi.org/10.1016/S0031-9422(01)00245-X
[(1S,4S,6S,8R,9R,12S,13S,16R)-9-hydroxy-7,7-dimethyl-17-methylidene-2,18-dioxo-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecan-6-yl] acetate	162956964	Click to see CC(=O)OC1CC2C3(COC(C3C1(C)C)O)C4CCC5CC4(C(=O)C5=C)C(=O)O2	404.50	unknown	https://doi.org/10.1016/S0040-4020(01)97055-3
[(1S,4S,6S,8R,9R,12S,13S,16S,17S)-9,14-dihydroxy-17-(methoxymethyl)-7,7-dimethyl-2,18-dioxo-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecan-6-yl] acetate	101158593	Click to see CC(=O)OC1CC2C3(COC(C3C1(C)C)O)C4C(CC5CC4(C(=O)C5COC)C(=O)O2)O	452.50	unknown	https://doi.org/10.1016/S0031-9422(01)00245-X
[(1S,4S,8R,9S,10S,11R,13S)-8-formyl-11-hydroxy-7,7-dimethyl-14-methylidene-2,15-dioxo-3-oxatetracyclo[11.2.1.01,10.04,9]hexadecan-9-yl]methyl acetate	101289758	Click to see CC(=O)OCC12C(CCC(C1C=O)(C)C)OC(=O)C34C2C(CC(C3)C(=C)C4=O)O	404.50	unknown	https://doi.org/10.1016/S0040-4020(01)97055-3
[3'-Acetyloxy-6'-(hydroxymethyl)-6'-methyl-10-methylidene-2,11-dioxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,2'-cyclohexane]-1'-yl]methyl acetate	74349213	Click to see CC(=O)OCC1C(CCC(C12COC(=O)C34C2CCC(C3)C(=C)C4=O)OC(=O)C)(C)CO	448.50	unknown	https://doi.org/10.1021/NP0705965
[4'-Acetyloxy-2'-(hydroxymethyl)-1'-methyl-10-methylidene-2,11-dioxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,3'-cyclohexane]-1'-yl]methyl acetate	74349146	Click to see CC(=O)OCC1(CCC(C2(C1CO)COC(=O)C34C2CCC(C3)C(=C)C4=O)OC(=O)C)C	448.50	unknown	https://doi.org/10.1021/NP0705965
[9,14-Dihydroxy-17-(methoxymethyl)-7,7-dimethyl-2,18-dioxo-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecan-6-yl] acetate	73880700	Click to see CC(=O)OC1CC2C3(COC(C3C1(C)C)O)C4C(CC5CC4(C(=O)C5COC)C(=O)O2)O	452.50	unknown	https://doi.org/10.1016/S0031-9422(01)00245-X
14,18-Dihydroxy-9-methoxy-7,7-dimethyl-17-methylidene-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecan-2-one	162945120	Click to see CC1(CCC2C3(C1C(OC3)OC)C4C(CC5CC4(C(C5=C)O)C(=O)O2)O)C	378.50	unknown	https://doi.org/10.1002/HLCA.200790243
6,9-Dihydroxy-7,7-dimethyl-17-methylidene-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecane-2,18-dione	3721623	Click to see CC1(C(CC2C3(C1C(OC3)O)C4CCC5CC4(C(=O)C5=C)C(=O)O2)O)C	362.40	unknown	https://doi.org/10.1016/S0040-4020(01)97055-3 https://doi.org/10.1002/PTR.2373 https://doi.org/10.1016/J.PHYTOCHEM.2004.02.022
9-Ethoxy-14-hydroxy-7,7-dimethyl-17-methylidene-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecane-2,18-dione	162980692	Click to see CCOC1C2C(CCC3C2(CO1)C4C(CC5CC4(C(=O)C5=C)C(=O)O3)O)(C)C	390.50	unknown	https://doi.org/10.1016/S0040-4020(01)97055-3
9,14-Dihydroxy-17-(methoxymethyl)-7,7-dimethyl-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecane-2,18-dione	162999088	Click to see CC1(CCC2C3(C1C(OC3)O)C4C(CC5CC4(C(=O)C5COC)C(=O)O2)O)C	394.50	unknown	https://doi.org/10.1016/S0031-9422(01)00245-X
9,14-Dihydroxy-7,7-dimethyl-17-methylidene-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecane-2,18-dione	430943	Click to see CC1(CCC2C3(C1C(OC3)O)C4C(CC5CC4(C(=O)C5=C)C(=O)O2)O)C	362.40	unknown	https://doi.org/10.1016/S0040-4020(01)97055-3 https://doi.org/10.1271/BBB1961.48.1647 https://doi.org/10.1016/S0031-9422(01)00245-X
Acetylexidonin	102004752	Click to see CC(=O)OCC1C(CCC(C12COC(=O)C34C2C(CC(C3)C(=C)C4=O)OC(=O)C)OC(=O)C)(C)C	490.50	unknown	https://doi.org/10.1021/NP50064A041
CID 442047	442047	Click to see CC(=O)OCC12C(CCC(C1C=O)(C)C)OC(=O)C34C2C(CC(C3)C(=C)C4=O)O	404.50	unknown	https://doi.org/10.1271/BBB1961.48.1647 https://doi.org/10.1016/S0040-4020(01)97055-3
Enmein	352542	Click to see CC1(C(CC2C3(C1C(OC3)O)C4CCC5CC4(C(=O)C5=C)C(=O)O2)O)C	362.40	unknown	https://doi.org/10.1016/S0040-4020(01)97055-3 https://doi.org/10.1016/S0367-326X(03)00107-2 https://doi.org/10.1271/BBB1961.48.1647 https://doi.org/10.1016/S0031-9422(01)00245-X
Epinodosin	9975896	Click to see CC1(CCC2C3(C1C(OC3)O)C4C(CC5CC4(C(=O)C5=C)C(=O)O2)O)C	362.40	unknown	https://doi.org/10.1016/S0040-4020(01)97055-3
Isodojaponin D	24899919	Click to see CC(=O)OCC1C(CCC(C12COC(=O)C34C2CCC(C3)C(=C)C4=O)OC(=O)C)(C)CO	448.50	unknown	https://doi.org/10.1021/NP0705965
Isodojaponin E	24899662	Click to see CC(=O)OCC1(CCC(C2(C1C=O)COC(=O)C34C2CCC(C3)C(=C)C4=O)OC(=O)C)C	446.50	unknown	https://doi.org/10.1021/NP0705965
Isodonoiol	51346130	Click to see CC(=O)OCC12C(CCC(C1CO)(C)C)OC(=O)C34C2C(CC(C3)C(=C)C4=O)O	406.50	unknown	https://doi.org/10.1016/S0031-9422(01)00245-X https://doi.org/10.1021/NP50064A041
Isojaponin	102034412	Click to see CC1(CCC2C3(C1C(OC3)OC)C4C(CC5CC4(C(C5=C)O)C(=O)O2)O)C	378.50	unknown	https://doi.org/10.1002/HLCA.200790243
Isojaponin B	101836941	Click to see CC(=O)OC1CCC(C(C12COC(=O)C34C2C(CC(C3)C(=C)C4O)O)CO)(C)C	408.50	unknown	https://doi.org/10.1002/HLCA.200790243
Loxothyrin A	6712389	Click to see CC(=O)OCC1(CCC(C2(C1C=O)COC(=O)C34C2C(CC(C3)C(=C)C4=O)O)OC(=O)C)C	462.50	unknown	https://doi.org/10.1016/J.PHYTOCHEM.2017.08.009 https://doi.org/10.1021/NP0705965
Nodosin	10248089	Click to see CC1(CCC2C3(C1C(OC3)O)C4C(CC5CC4(C(=O)C5=C)C(=O)O2)O)C	362.40	unknown	https://doi.org/10.1016/S0040-4020(01)97055-3
Rabdosin A	102034411	Click to see CC1(CCC2C3(C1C(OC3)OC)C4C(CC5CC4(C(=O)C5=C)C(=O)O2)O)C	376.40	unknown	https://doi.org/10.1016/S0031-9422(01)00245-X https://doi.org/10.1055/S-2002-32080
Rabdosin B	14109027	Click to see CC(=O)OCC1C(CCC(C12COC(=O)C34C2C(CC(C3)C(=C)C4=O)O)OC(=O)C)(C)C	448.50	unknown	https://doi.org/10.1016/0031-9422(90)85141-2
Rabdosin C	158213	Click to see CC(=O)OCC12C(CCC(C1CO)(C)C)OC(=O)C34C2C(CC(C3)C(=C)C4=O)O	406.50	unknown	https://doi.org/10.1016/S0031-9422(01)00245-X https://doi.org/10.1021/NP50064A041
Sculponeatin D	73075	Click to see CC1(C(CC2C3(C1C(OC3)O)C4CCC5CC4(C(=O)C5=C)C(=O)O2)O)C	362.40	unknown	https://doi.org/10.1016/S0367-326X(03)00107-2 https://doi.org/10.1271/BBB1961.48.1647 https://doi.org/10.1016/S0040-4020(01)97055-3 https://doi.org/10.1016/S0031-9422(01)00245-X https://doi.org/10.1002/PTR.2373
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
(1R,2R,4aR,6aR,6aR,6bR,8aR,10S,12aR,14aR,14bR)-2,10-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-1,5,6,6a,7,8,8a,10,11,12,13,14,14a,14b-tetradecahydropicene-4a-carboxylic acid	11442846	Click to see CC1C2C3CCC4C5(CCC(C(C5CCC4(C3(CCC2(C=CC1(C)O)C(=O)O)C)C)(C)C)O)C	472.70	unknown	via CMAUP database
(1S,2R,4aS,6aR,6aR,6bR,8aR,10S,12aR,14bS)-10-hydroxy-4a-[[(Z)-3-(4-hydroxyphenyl)prop-2-enoyl]oxymethyl]-1,2,6b,9,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-6a-carboxylic acid	6440661	Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C(=O)O)COC(=O)C=CC6=CC=C(C=C6)O	618.80	unknown	via CMAUP database
(1S,2R,4aS,6aR,6aS,6bR,8aS,10S,12aR,14bR)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid	38735514	Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O	456.70	unknown	via CMAUP database
(1S,2R,4aS,6aS,6aS,6bR,8aS,10S,12R,12aR,14bS)-10,12-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid	21672626	Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(C(CC(C5(C)C)O)O)C)C)C2C1C)C)C(=O)O	472.70	unknown	via CMAUP database
(2R,3S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-8a-(hydroxymethyl)-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-2,3-diol	21594131	Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1)C)CO)C	458.70	unknown	https://doi.org/10.1039/C39800001275
(3beta)-3,27-Dihydroxyolean-12-en-28-oic acid	12001894	Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)CO)C(=O)O)C	472.70	unknown	via CMAUP database
28-Norurs-12-ene-3beta-ol	44583863	Click to see CC1CCC2CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C	412.70	unknown	via CMAUP database
28-Norurs-12-ene-3beta,17beta-diol	21580512	Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)O	428.70	unknown	via CMAUP database
3beta,13-Dihydroxyurs-11-en-28-oic acid	44583862	Click to see CC1CCC2(CCC3(C4(CCC5C(C(CCC5(C4C=CC3(C2C1C)O)C)O)(C)C)C)C)C(=O)O	472.70	unknown	via CMAUP database
3beta,27-Dihydroxyurs-12-ene-28-oic acid	44583858	Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)CO)C(=O)O	472.70	unknown	via CMAUP database
8a-(Hydroxymethyl)-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-2,3-diol	15598301	Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1)C)CO)C	458.70	unknown	https://doi.org/10.1039/C39800001275
alpha-Amyrin	73170	Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C	426.70	unknown	via CMAUP database
Arjunolic acid	73641	Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1)C)C(=O)O)C	488.70	unknown	https://doi.org/10.1007/S11094-015-1200-5
Betulin	72326	Click to see CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)CO	442.70	unknown	via CMAUP database
Betulinic Acid	64971	Click to see CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C(=O)O	456.70	unknown	via CMAUP database
epi-Maslinic acid	25564831	Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1)C)C(=O)O)C	472.70	unknown	https://doi.org/10.1039/C39730000707
Lup-12-en-3-ol, (3beta,18beta,19beta)-	156497	Click to see CC(C)C1CCC2(C1C3=CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C	426.70	unknown	via CMAUP database
Maslinic acid methyl ester	609113	Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1)C)C(=O)OC)C	486.70	unknown	https://doi.org/10.1021/JA00398A034
methyl (1R,2R,4S,5R,6S,11S,14R,15R,18R,20S,23S)-20-hydroxy-8,8,14,15,19,19,23-heptamethyl-3-oxahexacyclo[13.8.0.02,4.05,14.06,11.018,23]tricosane-11-carboxylate	162929590	Click to see CC1(CCC2(CCC3(C(C2C1)C4C(O4)C5C3(CCC6C5(CCC(C6(C)C)O)C)C)C)C(=O)OC)C	486.70	unknown	https://doi.org/10.1021/JA00398A034
methyl (4aS,6aS,6bR,8aR,10S,12aR,12bR,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylate	122541	Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)OC)C	470.70	unknown	https://doi.org/10.1021/JA00398A034
Methyl 2,3-dihydroxyurs-12-en-28-oate	621722	Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1C)C)C(=O)OC	486.70	unknown	https://doi.org/10.1039/C39800001275
Methyl 20-hydroxy-8,8,14,15,19,19,23-heptamethyl-3-oxahexacyclo[13.8.0.02,4.05,14.06,11.018,23]tricosane-11-carboxylate	162929589	Click to see CC1(CCC2(CCC3(C(C2C1)C4C(O4)C5C3(CCC6C5(CCC(C6(C)C)O)C)C)C)C(=O)OC)C	486.70	unknown	https://doi.org/10.1021/JA00398A034
Methyl 3-epimaslinate	21594134	Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1)C)C(=O)OC)C	486.70	unknown	https://doi.org/10.1021/JA00398A034
Methyl 3-hydroxyurs-12-en-28-oate	621719	Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)OC	470.70	unknown	https://doi.org/10.1021/JA00398A034
Methyl corosolate	14109751	Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1C)C)C(=O)OC	486.70	unknown	https://doi.org/10.1039/C39800001275
Methyl maslinate	13653327	Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1)C)C(=O)OC)C	486.70	unknown	https://doi.org/10.1021/JA00398A034
Methyl oleanolate	92900	Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)OC)C	470.70	unknown	https://doi.org/10.1021/JA00398A034
Methyl ursolate	636516	Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)OC	470.70	unknown	https://doi.org/10.1021/JA00398A034
Oleanderolide	11113483	Click to see CC1(CCC23CCC4(C5(CCC6C(C(CCC6(C5CC(C4(C2C1)OC3=O)O)C)O)(C)C)C)C)C	472.70	unknown	via CMAUP database
Oleanolic Acid	10494	Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)O)C	456.70	unknown	https://doi.org/10.1039/C39860001141 https://doi.org/10.1016/S0031-9422(01)00245-X https://doi.org/10.1246/NIKKASHI.1985.799 https://doi.org/10.1021/JA00214A013 https://doi.org/10.1007/S11094-015-1200-5
trans-Karenin	101921671	Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C(=O)O)COC(=O)C=CC6=CC=C(C=C6)O	618.80	unknown	via CMAUP database
Urs-12(13)-ene	12302949	Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCCC5(C)C)C)C)C2C1C)C)C	410.70	unknown	via CMAUP database
Ursolic Acid	64945	Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O	456.70	unknown	https://doi.org/10.1039/C39860001141 https://doi.org/10.1246/NIKKASHI.1985.799 https://doi.org/10.1021/JA00214A013 https://doi.org/10.1007/S11094-015-1200-5
Ursolic aldehyde	14423521	Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C=O	440.70	unknown	via CMAUP database
Uvaol	92802	Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)CO	442.70	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Hydroxysteroids / 17-hydroxysteroids
3beta,22alpha,28-Trihydroxy-25-norlupa-1(10),20(29)-dien-2-one	102063062	Click to see CC(=C)C1CC(C2(C1C3CCC4C5=CC(=O)C(C(C5CCC4(C3(CC2)C)C)(C)C)O)CO)O	456.70	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Hydroxysteroids / 21-hydroxysteroids
21-Hydroxypregna-4,6-diene-3,12,20-trione	16104852	Click to see CC12CCC(=O)C=C1C=CC3C2CC(=O)C4(C3CCC4C(=O)CO)C	342.40	unknown	via CMAUP database
Neridienone B	44418781	Click to see CC12CCC(=O)C=C1C=CC3C2CC(=O)C4(C3CCC4C(CO)O)C	344.40	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Oxosteroids / 20-oxosteroids
Neridienone A	100630	Click to see CC(=O)C1=CCC2C1(C(CC3C2C=CC4=CC(=O)CCC34C)O)C	326.40	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Pregnane steroids / Gluco/mineralocorticoids, progestogins and derivatives
(17R)-12beta-Hydroxy-16beta,17-epoxypregna-4,6-diene-3,20-dione	16104853	Click to see CC(=O)C12C(O1)CC3C2(C(CC4C3C=CC5=CC(=O)CCC45C)O)C	342.40	unknown	via CMAUP database
21-Deoxyneridienone B	16104854	Click to see CC(C1CCC2C1(C(=O)CC3C2C=CC4=CC(=O)CCC34C)C)O	328.40	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroid lactones
beta-Anhydroepidigitoxigenin	10784500	Click to see CC12CCC(CC1CCC3C2CCC4(C3=CCC4C5=CC(=O)OC5)C)O	356.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroid lactones / Cardenolides and derivatives
3-[(3S,5R,8R,9R,10S,13R,14S,16S,17R)-3,14,16-trihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one	11870451	Click to see CC12CCC(CC1CCC3C2CCC4(C3(CC(C4C5=CC(=O)OC5)O)O)C)O	390.50	unknown	via CMAUP database
7beta,14-Dihydroxy-5alpha-card-20(22)-enolide	101630403	Click to see CC12CCCCC1CC(C3C2CCC4(C3(CCC4C5=CC(=O)OC5)O)C)O	374.50	unknown	via CMAUP database
Digitoxigenin	4369270	Click to see CC12CCC(CC1CCC3C2CCC4(C3(CCC4C5=CC(=O)OC5)O)C)O	374.50	unknown	via CMAUP database
Gitoxigenin	348482	Click to see CC12CCC(CC1CCC3C2CCC4(C3(CC(C4C5=CC(=O)OC5)O)O)C)O	390.50	unknown	via CMAUP database
Oleandrigenin	9802865	Click to see CC(=O)OC1CC2(C3CCC4CC(CCC4(C3CCC2(C1C5=CC(=O)OC5)C)C)O)O	432.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroid lactones / Cardenolides and derivatives / Cardenolide glycosides and derivatives
[(3S,5R,8R,9S,10S,13R,14S,16S,17R)-14-hydroxy-3-[(2R,4R,5S,6R)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-16-yl] acetate	12304185	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CC(C5C6=CC(=O)OC6)OC(=O)C)O)C)C)OC)O	576.70	unknown	via CMAUP database
16beta-Acetoxy-3beta-[(3-O-methyl-4-O-beta-D-glucopyranosyl-6-deoxy-beta-D-galactopyranosyl)oxy]-14-hydroxy-5beta-carda-20(22)-enolide	101633449	Click to see CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CC(C5C6=CC(=O)OC6)OC(=O)C)O)C)C)O)OC)OC7C(C(C(C(O7)CO)O)O)O	754.90	unknown	via CMAUP database
16beta-Acetoxy-3beta-[(4-O-beta-D-glucopyranosyl-3-O-methyl-6-deoxy-beta-D-galactopyranosyl)oxy]-14beta-hydroxy-5alpha-card-20(22)-enolide	101632317	Click to see CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CC(C5C6=CC(=O)OC6)OC(=O)C)O)C)C)O)OC)OC7C(C(C(C(O7)CO)O)O)O	754.90	unknown	via CMAUP database
3-[(3S,5S,8R,9S,10R,13R,14S,17R)-5,14-dihydroxy-3-[(2R,4R,5S,6R)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-10,13-dimethyl-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one	11800467	Click to see CC1C(C(CC(O1)OC2CCC3(C4CCC5(C(CCC5(C4CCC3(C2)O)O)C6=CC(=O)OC6)C)C)OC)O	534.70	unknown	via CMAUP database
3-[(3S,5S,8R,9S,10S,13R,14S,17R)-3-[(2R,3R,4S,5S,6R)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy-14-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one	101632321	Click to see CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CCC5C6=CC(=O)OC6)O)C)C)O)OC)O	534.70	unknown	via CMAUP database
3beta-[(2,6-Dideoxy-3-O-methyl-4-O-beta-D-glucopyranosyl-beta-D-galactopyranosyl)oxy]-14-hydroxy-5beta,14beta-card-20(22)-enolide	101634824	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CCC5C6=CC(=O)OC6)O)C)C)OC)OC7C(C(C(C(O7)CO)O)O)O	680.80	unknown	via CMAUP database
3beta-[(2,6-Dideoxy-3-O-methyl-4-O-beta-D-glucopyranosyl-beta-D-galactopyranosyl)oxy]-16beta-acetoxy-14-hydroxy-5beta,14beta-card-20(22)-enolide	51351560	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CC(C5C6=CC(=O)OC6)OC(=O)C)O)C)C)OC)OC7C(C(C(C(O7)CO)O)O)O	738.90	unknown	via CMAUP database
3beta-[(2,6-Dideoxy-4-O-beta-D-glucopyranosyl-3-O-methyl-beta-D-galactopyranosyl)oxy]-14-hydroxy-5alpha,14beta-card-20(22)-enolide	101632322	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CCC5C6=CC(=O)OC6)O)C)C)OC)OC7C(C(C(C(O7)CO)O)O)O	680.80	unknown	via CMAUP database
3beta-[[2,6-Dideoxy-3-O-methyl-4-O-(6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)-beta-D-galactopyranosyl]oxy]-14-hydroxy-5alpha,14beta-card-20(22)-enolide	101632323	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CCC5C6=CC(=O)OC6)O)C)C)OC)OC7C(C(C(C(O7)COC8C(C(C(C(O8)CO)O)O)O)O)O)O	843.00	unknown	via CMAUP database
3beta-[[4-O-(6-O-beta-D-Glucopyranosyl-beta-D-glucopyranosyl)-2,6-dideoxy-3-O-methyl-beta-D-galactopyranosyl]oxy]-14-hydroxy-5beta,14beta-card-20(22)-enolide	101634825	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CCC5C6=CC(=O)OC6)O)C)C)OC)OC7C(C(C(C(O7)COC8C(C(C(C(O8)CO)O)O)O)O)O)O	843.00	unknown	via CMAUP database
3beta-[3-O-Methyl-2,6-dideoxy-beta-D-idopyranosyloxy]-14beta,16beta-dihydroxy-5beta-cardanolide-20(22)-ene	122365792	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CC(C5C6=CC(=O)OC6)O)O)C)C)OC)O	534.70	unknown	via CMAUP database
3beta-[4-O-(beta-D-Glucopyranosyl)-3-O-methyl-2,6-dideoxy-beta-D-lyxo-hexopyranosyloxy]-14-hydroxy-16beta-acetoxy-5alpha,14beta-carda-20(22)-enolide	102484066	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CC(C5C6=CC(=O)OC6)OC(=O)C)O)C)C)OC)OC7C(C(C(C(O7)CO)O)O)O	738.90	unknown	via CMAUP database
3beta-[4-O-(beta-D-Glucopyranosyl)-3-O-methyl-2,6-dideoxy-beta-D-lyxo-hexopyranosyloxy]-8,14-epoxy-5beta,14beta-carda-20(22)-enolide	102484064	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC45C3CCC6(C4(O5)CCC6C7=CC(=O)OC7)C)C)OC)OC8C(C(C(C(O8)CO)O)O)O	678.80	unknown	via CMAUP database
8-Hydroxyodoroside A	44425148	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4(C3CCC5(C4(CCC5C6=CC(=O)OC6)O)C)O)C)OC)O	534.70	unknown	via CMAUP database
8,14-Epoxy-3beta-[(6-deoxy-3-O-methyl-4-O-beta-D-glucopyranosyl-beta-D-galactopyranosyl)oxy]-5beta-card-20(22)-enolide	101633900	Click to see CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC45C3CCC6(C4(O5)CCC6C7=CC(=O)OC7)C)C)O)OC)OC8C(C(C(C(O8)CO)O)O)O	694.80	unknown	via CMAUP database
Adynerigenin beta-neritrioside	91886678	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC45C3CCC6(C4(O5)CCC6C7=CC(=O)OC7)C)C)OC)OC8C(C(C(C(O8)COC9C(C(C(C(O9)CO)O)O)O)O)O)O	840.90	unknown	via CMAUP database
Adynerin	441840	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC45C3CCC6(C4(O5)CCC6C7=CC(=O)OC7)C)C)OC)O	516.70	unknown	via CMAUP database
Cardenolide B-1	46872929	Click to see CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC45C3CCC6(C4(O5)CCC6C7=CC(=O)OC7)C)C)O)OC)O	532.70	unknown	via CMAUP database
Cardenolide B-3	101482497	Click to see CC1C(C(CC(O1)OC2CCC3(C4CCC5(C(CCC5(C46C(O6)CC3C2)O)C7=CC(=O)OC7)C)C)OC)OC8C(C(C(C(O8)COC9C(C(C(C(O9)CO)O)O)O)O)O)O	856.90	unknown	via CMAUP database
Cardenolide B2	46872930	Click to see CC1C(C(CC(O1)OC2CCC3(C4CCC5(C(CCC5(C46C(O6)CC3C2)O)C7=CC(=O)OC7)C)C)OC)O	532.70	unknown	via CMAUP database
Carenolide N-1	16756311	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CCC5C6=CC(=O)OC6)O)C)C)OC)O	518.70	unknown	via CMAUP database
Carenolide N-3	16756312	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC45C3CCC6(C4(O5)CC7C6(O7)C8=CC(=O)OC8)C)C)OC)O	530.60	unknown	via CMAUP database
Carenolide N-4	16756310	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CC(C5C6=CC(=O)OC6)OC(=O)C)O)C)C)OC)O	576.70	unknown	via CMAUP database
CID 101600017	101600017	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CCC5C6=CC(=O)OC6)O)C)C)OC)O	518.70	unknown	via CMAUP database
CID 101633451	101633451	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CC(C5C6=CC(=O)OC6)O)O)C)C)OC)O	534.70	unknown	via CMAUP database
Cryptogranodoside A	44425149	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CC(C5C6=CC(=O)OC6)OC(=O)C)O)C)C)OC)O	576.70	unknown	via CMAUP database
Desacetyloleandrin	76962086	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CC(C5C6=CC(=O)OC6)O)O)C)C)OC)O	534.70	unknown	via CMAUP database
Digitalin	441856	Click to see CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CC(C5C6=CC(=O)OC6)O)O)C)C)O)OC)OC7C(C(C(C(O7)CO)O)O)O	712.80	unknown	via CMAUP database
Neritaloside	44566654	Click to see CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CC(C5C6=CC(=O)OC6)OC(=O)C)O)C)C)O)OC)O	592.70	unknown	via CMAUP database
Odorobioside G	12313683	Click to see CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CCC5C6=CC(=O)OC6)O)C)C)O)OC)OC7C(C(C(C(O7)CO)O)O)O	696.80	unknown	via CMAUP database
Odoroside A	44425145	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CCC5C6=CC(=O)OC6)O)C)C)OC)O	518.70	unknown	via CMAUP database
Odoroside H	205840	Click to see CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CCC5C6=CC(=O)OC6)O)C)C)O)OC)O	534.70	unknown	via CMAUP database
Odoroside K	101632315	Click to see CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CCC5C6=CC(=O)OC6)O)C)C)O)OC)OC7C(C(C(C(O7)CO)O)O)O	696.80	unknown	via CMAUP database
Oleandrigenin beta-D-glucosyl-beta-D-sarmentoside	51351559	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CC(C5C6=CC(=O)OC6)OC(=O)C)O)C)C)OC)OC7C(C(C(C(O7)CO)O)O)O	738.90	unknown	via CMAUP database
Oleandrin	11541511	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CC(C5C6=CC(=O)OC6)OC(=O)C)O)C)C)OC)O	576.70	unknown	via CMAUP database
Strospeside	21636336	Click to see CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CC(C5C6=CC(=O)OC6)O)O)C)C)O)OC)O	550.70	unknown	via CMAUP database
Urechitoxin	171542	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CC(C5C6=CC(=O)OC6)OC(=O)C)O)C)C)OC)OC7C(C(C(C(O7)CO)O)O)O	738.90	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal glycosides
3beta-[[6-Deoxy-3-O-methyl-beta-D-galactopyranosyl]oxy]-14-hydroxy-5beta,14beta-carda-16,20(22)-dienolide	101632319	Click to see CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CC=C5C6=CC(=O)OC6)O)C)C)O)OC)O	532.70	unknown	via CMAUP database
Narizoside	10816404	Click to see CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CC=C5C6=CC(=O)OC6)O)C)C)OC)OC)O	546.70	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol	6743	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C)C(C)C	416.70	unknown	https://doi.org/10.1021/JA00398A034
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/10.1039/C39860001139 https://doi.org/10.1016/0031-9422(89)80201-8 https://doi.org/10.1016/S0031-9422(01)00245-X https://doi.org/10.1039/C39800001275 https://doi.org/10.1016/S0367-326X(03)00107-2 https://doi.org/10.1007/S11094-015-1200-5 https://doi.org/10.1021/JA00398A034
24-Ethylcholest-5-en-3beta-ol	22012	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	414.70	unknown	https://doi.org/10.1039/C39860001139 https://doi.org/10.1007/S11094-015-1200-5 https://doi.org/10.1016/0031-9422(89)80201-8 https://doi.org/10.1016/S0367-326X(03)00107-2 https://doi.org/10.1016/S0031-9422(01)00245-X
Beta-Sitosterol	222284	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	414.70	unknown	https://doi.org/10.1016/0031-9422(89)80201-8 https://doi.org/10.1021/JA00398A034 https://doi.org/10.1039/C39800001275
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/10.1016/S0367-326X(03)00107-2
hexyl 4-[[(3S,8S,9S,10R,13R,14S,17R)-17-[(E,2R,5S)-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-yl]oxy]benzoate	60168070	Click to see CCCCCCOC(=O)C1=CC=C(C=C1)OC2CCC3(C4CCC5(C(C4CC=C3C2)CCC5C(C)C=CC(CC)C(C)C)C)C	617.00	unknown	via CMAUP database
Sitogluside	5742590	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C	576.80	unknown	https://doi.org/10.1016/S0367-326X(03)00107-2 https://doi.org/10.1246/NIKKASHI.1985.799 https://doi.org/10.1007/S11094-015-1200-5
Stigmastanol	241572	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C)C(C)C	416.70	unknown	https://doi.org/10.1021/JA00398A034
Stigmasterol	5280794	Click to see CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	412.70	unknown	via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Carboxylic acid derivatives / Carboxylic acid esters
Ethyl Acetate	8857	Click to see CCOC(=O)C	88.11	unknown	via CMAUP database
> Organic acids and derivatives / Keto acids and derivatives / Short-chain keto acids and derivatives
(R)-3-Hydroxy-2-oxobutanoicacid	15284009	Click to see CC(C(=O)C(=O)O)O	118.09	unknown	via CMAUP database
4-Hydroxy-2-oxobutanoic acid	11963036	Click to see C(CO)C(=O)C(=O)O	118.09	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Quinic acids and derivatives
3-[3-(3,4-Dihydroxyphenyl)prop-2-enoyloxy]-1,4,5-trihydroxy-cyclohexanecarboxylic acid	348159	Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O	354.31	unknown	https://doi.org/10.1271/BBB.59.1780
Chlorogenic Acid	1794427	Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O	354.31	unknown	https://doi.org/10.1271/BBB.59.1780
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Primary alcohols
(S)-(-)-2-Methyl-1-butanol	2723602	Click to see CCC(C)CO	88.15	unknown	via CMAUP database
1-Butanol	263	Click to see CCCCO	74.12	unknown	via CMAUP database
Isoamyl alcohol	31260	Click to see CC(C)CCO	88.15	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Secondary alcohols
(S)-(+)-2-Pentanol	2724896	Click to see CCCC(C)O	88.15	unknown	via CMAUP database
3-Methyl-3-buten-2-ol, (R)-	10678185	Click to see CC(C(=C)C)O	86.13	unknown	via CMAUP database
3-Pentanol	11428	Click to see CCC(CC)O	88.15	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds
3-[(1R,2S,4R,6S,9S,10R,13R,14R)-2-hydroxy-6-[(2R,4R,5S,6R)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-9,13-dimethyl-17-oxo-14-tetracyclo[11.3.1.01,10.04,9]heptadecanyl]-2H-furan-5-one	76285478	Click to see CC1C(C(CC(O1)OC2CCC3(C4CCC5(C(CCC4(C5=O)C(CC3C2)O)C6=CC(=O)OC6)C)C)OC)O	532.70	unknown	via CMAUP database
8,14-Epoxy-3beta-[(3-O-methyl-2,6-dideoxy-beta-D-lyxo-hexopyranosyl)oxy]-5beta,14beta-carda-16,20(22)-dienolide	44425147	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC45C3CCC6(C4(O5)CC=C6C7=CC(=O)OC7)C)C)OC)O	514.60	unknown	via CMAUP database
Carenolide N-2	16756207	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC45C3CCC6(C4(O5)CC=C6C7=CC(=O)OC7)C)C)OC)O	514.60	unknown	via CMAUP database
Dehydroadynerigenin beta-neritrioside	102004568	Click to see CC1C(C(CC(O1)OC2CCC3(C(C2)CCC45C3CCC6(C4(O5)CC=C6C7=CC(=O)OC7)C)C)OC)OC8C(C(C(C(O8)COC9C(C(C(C(O9)CO)O)O)O)O)O)O	838.90	unknown	via CMAUP database
Dehydroadynerigenin digitaloside	101633902	Click to see CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC45C3CCC6(C4(O5)CC=C6C7=CC(=O)OC7)C)C)O)OC)O	530.60	unknown	via CMAUP database
Dehydroadynerigenin glucosyldigitaloside	92023995	Click to see CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC45C3CCC6(C4(O5)CC=C6C7=CC(=O)OC7)C)C)O)OC)OC8C(C(C(C(O8)CO)O)O)O	692.80	unknown	via CMAUP database
Salidroside	159278	Click to see C1=CC(=CC=C1CCOC2C(C(C(C(O2)CO)O)O)O)O	300.30	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides
[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-(4-hydroxyphenoxy)oxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate	5315597	Click to see C1=CC(=CC=C1O)OC2C(C(C(C(O2)CO)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O	434.40	unknown	via CMAUP database
4-[6-O-(beta-D-Glucopyranosyl)-beta-D-glucopyranosyloxy]phenol	11968602	Click to see C1=CC(=CC=C1O)OC2C(C(C(C(O2)COC3C(C(C(C(O3)CO)O)O)O)O)O)O	434.40	unknown	via CMAUP database
Pyroside	5315513	Click to see CC(=O)OCC1C(C(C(C(O1)OC2=CC=C(C=C2)O)O)O)O	314.29	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Alpha-hydrogen aldehydes
Valeraldehyde	8063	Click to see CCCCC=O	86.13	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Medium-chain aldehydes
(E,Z)-2,4-heptadienal	11788274	Click to see CCC=CC=CC=O	110.15	unknown	via CMAUP database
2-Decenal	5283345	Click to see CCCCCCCC=CC=O	154.25	unknown	via CMAUP database
2-Heptenal	5283316	Click to see CCCCC=CC=O	112.17	unknown	via CMAUP database
2-Nonenal	5283335	Click to see CCCCCCC=CC=O	140.22	unknown	via CMAUP database
2,4-Decadienal	5283349	Click to see CCCCCC=CC=CC=O	152.23	unknown	via CMAUP database
2,4-Heptadienal	5283321	Click to see CCC=CC=CC=O	110.15	unknown	via CMAUP database
Decanal	8175	Click to see CCCCCCCCCC=O	156.26	unknown	via CMAUP database
Heptanal	8130	Click to see CCCCCCC=O	114.19	unknown	via CMAUP database
Hexanal	6184	Click to see CCCCCC=O	100.16	unknown	via CMAUP database
Nonanal	31289	Click to see CCCCCCCCC=O	142.24	unknown	via CMAUP database
Octanal	454	Click to see CCCCCCCC=O	128.21	unknown	via CMAUP database
trans-2,cis-6-Nonadienal	643731	Click to see CCC=CCCC=CC=O	138.21	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones
2-Octadecanone	81844	Click to see CCCCCCCCCCCCCCCCC(=O)C	268.50	unknown	via CMAUP database
6-Methyl-5-hepten-2-one	9862	Click to see CC(=CCCC(=O)C)C	126.20	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones / Alpha-diketones
2,3-Butanedione	650	Click to see CC(=O)C(=O)C	86.09	unknown	via CMAUP database
> Organoheterocyclic compounds / Indoles and derivatives / Carbazoles
4-(3,7-Dimethyl-2,6-octadienyl)-3-hydroxy-6-methyl-9H-carbazole	14635307	Click to see CC1=CC2=C(C=C1)NC3=C2C(=C(C=C3)O)CC=C(C)CCC=C(C)C	333.50	unknown	https://doi.org/10.1021/NP0705965
> Organoheterocyclic compounds / Isoindoles and derivatives / Isoindolines / Isoindolones
(1R,4E,6R,10R,12E,14S,17S,18S,19S)-19-benzyl-6-hydroxy-10,16,17-trimethyl-2-oxa-20-azatricyclo[12.7.0.01,18]henicosa-4,12,15-triene-3,21-dione	51340743	Click to see CC1CCCC(C=CC(=O)OC23C(C=CC1)C=C(C(C2C(NC3=O)CC4=CC=CC=C4)C)C)O	463.60	unknown	via CMAUP database
Cytochalasin Z2	76322839	Click to see CC1CCCC(C=CC(=O)OC23C(C=CC1)C=C(C(C2C(NC3=O)CC4=CC=CC=C4)C)CO)O	479.60	unknown	via CMAUP database
Deoxaphomin	76333666	Click to see CC1CCCC(C=CC(=O)C23C(C=CC1)C(C(=C)C(C2C(NC3=O)CC4=CC=CC=C4)C)O)O	463.60	unknown	via CMAUP database
> Organoheterocyclic compounds / Lactones / Gamma butyrolactones
3beta,13,27-Trihydroxyurs-18-en-28-oic acid gamma-lactone	102062194	Click to see CC1CCC23CCC4(C5(CCC6C(C(CCC6(C5CCC4(C2=C1C)OC3=O)C)O)(C)C)C)CO	470.70	unknown	via CMAUP database
> Organoheterocyclic compounds / Naphthopyrans
[9-(Acetyloxymethyl)-11-hydroxy-7,7-dimethyl-14-methylidene-2,15-dioxo-5-oxatetracyclo[11.2.1.01,10.04,9]hexadecan-8-yl]methyl acetate	5320878	Click to see CC(=O)OCC1C(COC2C1(C3C(CC4CC3(C(=O)C2)C(=O)C4=C)O)COC(=O)C)(C)C	448.50	unknown	https://doi.org/10.1016/0031-9422(90)85141-2
> Organoheterocyclic compounds / Oxepanes
16,17-Didehydroadynerigenin	101713198	Click to see CC12CCC(CC1CCC34C2CCC5(C3(O4)CC=C5C6=CC(=O)OC6)C)O	370.50	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Cinnamic acid esters / O-cinnamoyl glycosides
1-O-trans-Cinnamoyl-beta-D-glucopyranose	5280653	Click to see C1=CC=C(C=C1)C=CC(=O)OC2C(C(C(C(O2)CO)O)O)O	310.30	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Cinnamic acids
2-Propenoic acid, 3-phenyl-	8784	Click to see C1=CC=C(C=C1)C=CC(=O)O	148.16	unknown	https://doi.org/10.1271/BBB.59.1780
Cinnamic acid	444539	Click to see C1=CC=C(C=C1)C=CC(=O)O	148.16	unknown	https://doi.org/10.1271/BBB.59.1780
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives
3-(3,4-dihydroxyphenyl)-2-[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]propanoic acid	5099	Click to see C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O	360.30	unknown	https://doi.org/10.1002/PTR.2373
Hexacosyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate	20980932	Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCOC(=O)C=CC1=CC(=C(C=C1)O)OC	558.90	unknown	https://doi.org/10.1246/NIKKASHI.1985.799
Rosmarinic acid	5281792	Click to see C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O	360.30	unknown	https://doi.org/10.1246/NIKKASHI.1985.1513 https://doi.org/10.1002/PTR.2373
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids
(E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid	2518	Click to see C1=CC(=C(C=C1C=CC(=O)O)O)O	180.16	unknown	https://doi.org/10.1271/BBB.59.1780
3-(4-Hydroxy-3-methoxyphenyl)prop-2-enoic acid	709	Click to see COC1=C(C=CC(=C1)C=CC(=O)O)O	194.18	unknown	https://doi.org/10.1271/BBB.59.1780
Caffeic Acid	689043	Click to see C1=CC(=C(C=C1C=CC(=O)O)O)O	180.16	unknown	https://doi.org/10.1271/BBB.59.1780
Ferulic acid	445858	Click to see COC1=C(C=CC(=C1)C=CC(=O)O)O	194.18	unknown	https://doi.org/10.1271/BBB.59.1780
Sinapic acid	10743	Click to see COC1=CC(=CC(=C1O)OC)C=CC(=O)O	224.21	unknown	https://doi.org/10.1271/BBB.59.1780
Sinapinic acid	637775	Click to see COC1=CC(=CC(=C1O)OC)C=CC(=O)O	224.21	unknown	https://doi.org/10.1271/BBB.59.1780
> Phenylpropanoids and polyketides / Coumarins and derivatives / Coumarin glycosides
Scopolin	439514	Click to see COC1=C(C=C2C(=C1)C=CC(=O)O2)OC3C(C(C(C(O3)CO)O)O)O	354.31	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Biflavonoids and polyflavonoids
3,3'-Digalloylprocyanidin B2	124016	Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)OC(=O)C6=CC(=C(C(=C6)O)O)O)O)O)C7=CC(=C(C=C7)O)O)OC(=O)C8=CC(=C(C(=C8)O)O)O	882.70	unknown	via CMAUP database
Cinnamtannin B1	475277	Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=C3C(=CC5=C4C6C(C(O5)(OC7=CC(=CC(=C67)O)O)C8=CC(=C(C=C8)O)O)O)O)C9=CC(=C(C=C9)O)O)O)O)O)C1=CC(=C(C=C1)O)O)O	864.80	unknown	via CMAUP database
Cinnamtannin B2	16130973	Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=C3C(=CC5=C4C6C(C(O5)(OC7=C(C(=CC(=C67)O)O)C8C(C(OC9=CC(=CC(=C89)O)O)C1=CC(=C(C=C1)O)O)O)C1=CC(=C(C=C1)O)O)O)O)C1=CC(=C(C=C1)O)O)O)O)O)C1=CC(=C(C=C1)O)O)O	1153.00	unknown	via CMAUP database
Cinnamtannin D1	46173958	Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=C3C(=CC5=C4C6C(C(O5)(OC7=CC(=CC(=C67)O)O)C8=CC(=C(C=C8)O)O)O)O)C9=CC(=C(C=C9)O)O)O)O)O)C1=CC(=C(C=C1)O)O)O	864.80	unknown	via CMAUP database
Epicatechin-(4beta->8)-epicatechin-(2beta->7,4beta->8)-catechin	10350652	Click to see C1C(C(OC2=C1C(=CC3=C2C4C(C(O3)(OC5=C(C(=CC(=C45)O)O)C6C(C(OC7=CC(=CC(=C67)O)O)C8=CC(=C(C=C8)O)O)O)C9=CC(=C(C=C9)O)O)O)O)C1=CC(=C(C=C1)O)O)O	864.80	unknown	via CMAUP database
Proanthocyanidin A1	9872976	Click to see C1C(C(OC2=C1C(=CC3=C2C4C(C(O3)(OC5=CC(=CC(=C45)O)O)C6=CC(=C(C=C6)O)O)O)O)C7=CC(=C(C=C7)O)O)O	576.50	unknown	via CMAUP database
Procyanidin A2	124025	Click to see C1C(C(OC2=C1C(=CC3=C2C4C(C(O3)(OC5=CC(=CC(=C45)O)O)C6=CC(=C(C=C6)O)O)O)O)C7=CC(=C(C=C7)O)O)O	576.50	unknown	via CMAUP database
Procyanidin B1	11250133	Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O	578.50	unknown	via CMAUP database
Procyanidin B3	146798	Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O	578.50	unknown	via CMAUP database
Procyanidin B6	474540	Click to see C1C(C(OC2=C1C(=C(C(=C2)O)C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)C6=CC(=C(C=C6)O)O)O	578.50	unknown	via CMAUP database
Procyanidin B7	13990893	Click to see C1C(C(OC2=C1C(=C(C(=C2)O)C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)C6=CC(=C(C=C6)O)O)O	578.50	unknown	via CMAUP database
Procyanidin B8	474541	Click to see C1C(C(OC2=C1C(=C(C(=C2)O)C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)C6=CC(=C(C=C6)O)O)O	578.50	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins
2-(3,4-Dihydroxyphenyl)chroman-3,5,7-triol	1203	Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O	290.27	unknown	https://doi.org/10.1271/BBB.59.1780
Cianidanol	9064	Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O	290.27	unknown	https://doi.org/10.1271/BBB.59.1780
Epicatechin	72276	Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O	290.27	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavones / Flavonols
Kaempferol	5280863	Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O	286.24	unknown	via CMAUP database
Quercetin	5280343	Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O	302.23	unknown	https://doi.org/10.1002/PTR.2373
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glucuronides / Flavonoid-7-O-glucuronides
Luteolin 7-glucuronide	5280601	Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)C(=O)O)O)O)O)O)O)O	462.40	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one	11972444	Click to see CC1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C=C4)O)O)O)O)O	448.40	unknown	via CMAUP database
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2R,3S,4R,5S)-3,4,5-trihydroxyoxan-2-yl]oxychromen-4-one	26202188	Click to see C1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C=C4)O)O)O)O)O	434.30	unknown	via CMAUP database
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one	51402807	Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O	464.40	unknown	https://doi.org/10.1246/NIKKASHI.1985.1513
2-(3,4-Dihydroxyphenyl)-5,7-Dihydroxy-3-[(2S,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-yl]Oxy-Chromen-4-one	12304323	Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O	464.40	unknown	via CMAUP database
Avicularin	5490064	Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(O4)CO)O)O)O)O	434.30	unknown	via CMAUP database
Cacticin	5318644	Click to see COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O	478.40	unknown	via CMAUP database
Guaijaverin	5481224	Click to see C1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C=C4)O)O)O)O)O	434.30	unknown	via CMAUP database
Hyperoside	5281643	Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O	464.40	unknown	via CMAUP database
Isoquercitin	10813969	Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O	464.40	unknown	via CMAUP database
Kaempferol-3-O-rutinoside	5318767	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O)O)O	594.50	unknown	via CMAUP database
Quercetin 3-O-beta-D-xylopyranoside	5320861	Click to see C1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C=C4)O)O)O)O)O	434.30	unknown	via CMAUP database
Quercetin-3-o-alpha-d-arabinofuranoside	11968848	Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(O4)CO)O)O)O)O	434.30	unknown	via CMAUP database
Quercitrin	5280459	Click to see CC1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C=C4)O)O)O)O)O	448.40	unknown	via CMAUP database
Rutin	5280805	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O	610.50	unknown	https://doi.org/10.1246/NIKKASHI.1985.1513 https://doi.org/10.1007/S11094-015-1200-5
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 4-O-methylated flavonoids
Diosmetin	5281612	Click to see COC1=C(C=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O	300.26	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 7-O-methylated flavonoids
Cirsiliol	160237	Click to see COC1=C(C(=C2C(=C1)OC(=CC2=O)C3=CC(=C(C=C3)O)O)O)OC	330.29	unknown	https://doi.org/10.1055/S-2002-32080
Pedalitin	31161	Click to see COC1=C(C(=C2C(=C1)OC(=CC2=O)C3=CC(=C(C=C3)O)O)O)O	316.26	unknown	https://doi.org/10.1246/NIKKASHI.1985.1513 https://doi.org/10.1002/PTR.2373
> Phenylpropanoids and polyketides / Isoflavonoids / Isoflavonoid C-glycosides
6-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]-3-(2,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one	162982234	Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2C3=C(C4=C(C=C3O)OC=C(C4=O)C5=C(C=C(C=C5)O)O)O)CO)O)O)O)O)O	594.50	unknown	https://doi.org/10.1016/S0040-4020(01)97055-3
> Phenylpropanoids and polyketides / Isoflavonoids / O-methylated isoflavonoids / 4-O-methylated isoflavonoids / 4-O-methylisoflavones
7-(6,7-Dihydroxy-3,7-dimethyloct-2-enoxy)-3-(4-methoxyphenyl)chromen-4-one	162994344	Click to see CC(=CCOC1=CC2=C(C=C1)C(=O)C(=CO2)C3=CC=C(C=C3)OC)CCC(C(C)(C)O)O	438.50	unknown	https://doi.org/10.1016/S0031-9422(00)98002-6 https://doi.org/10.1248/CPB.36.3223

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Isodon japonicus

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