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Actaea simplex

Actaea simplex - Unknown
Part: Unknown
Author: Public Domain - WikiMedia
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Table of Contents

Details
Description
Synonyms
Common Names
Subtypes (subspecies, varieties, subvarieties, forms)
Germination/Propagation
Distribution
Links to other databases
Genome
Scientific Literature
Phytochemical Profile
Biological Material
Contributors
Collections

Details Top

Internal ID UUID6440073778945360956624
Scientific name Actaea simplex
Authority Prantl
First published in Bot. Jahrb. Syst. 9: 246 (1887)

Description Top

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No description added yet. Help us by writing one.

Synonyms Top

Scientific name Authority First published in
Actaea cimicifuga var. simplex DC. Prodr. 1: 64 1824
Actaea yesoensis (Nakai) J.Compton & Hedd. Taxon 47: 624 (1998)
Cimicifuga dahurica var. tschonoskii Huth Bot. Jahrb. Syst. 16: 317 1893
Cimicifuga foetida var. intermedia Regel Reis. Ostsib. 1: 121 1861
Cimicifuga foetida f. laciniata Makino Fl. Japan 966 1925
Cimicifuga foetida f. purpurea Makino J. Jap. Bot. 3: 39 1926
Cimicifuga foetida var. simplex (DC.) G.Don Gen. Hist. 1: 64 1831
Cimicifuga ramosa (Maxim. ex Franch. & Sav.) Nakai Index Seminum (TI) 1932: 15 1932
Cimicifuga simplex Wormsk. ex DC. Bull. Soc. Imp. Naturalistes Moscou 15: 87 (1842)
Cimicifuga simplex var. ramosa Maxim. ex Franch. & Sav. Enum. Pl. Jap. 1: 13 1875
Cimicifuga simplex var. yesoensis Nakai Bot. Mag. (Tokyo) 30: 146 1916
Cimicifuga taquetii H.Lév. Repert. Spec. Nov. Regni Veg. 9: 448 (1911)
Cimicifuga ussuriensis Oett. Trudy Bot. Sada Imp. Yur'evsk. Univ. 6: 138 (1906)
Cimicifuga yezoensis Kudô J. Coll. Agric. Hokkaido Imp. Univ. 12: 36 (1923)
Cimicifuga simplex var. intermedia (Regel) Nakai Bot. Mag. (Tokyo) 30: 146 1916
Cimicifuga foetida var. simplex (DC.) Regel Tent. Fl. Ussur. 13 1861
Thalictrodes simplex Kuntze Revis. Gen. Pl. 1: 4 (1891)

Common names Top

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Language Common/alternative name
English cimicifuga simplex
Spanish cimicifuga simplex
Azerbaijani cimicifuga simplex
Azerbaijani sadə simisifuqa
French cimicifuga simplex
Japanese ショウマ
Japanese 升麻
Japanese サラシナショウマ
Korean 촛대승마
Chinese 单穗升麻
Chinese 單穗升麻

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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Begin at 20°C for 6 weeks, cool to 4°C for 6 weeks, then gradually increase to 10°C over 6 weeks. If no germination, the cycle is repeated.
Sow seeds immediately as their viability decreases rapidly, or they best germinate when fresh. If stored, seeds might need temperature cycling and patience to germinate.

Distribution (via POWO/KEW) Top

Legend for the distribution data:
- Doubtful data
- Extinct
- Introduced
- Native
  • Asia-temperate
    • China
      • China North-central
      • China South-central
      • China Southeast
      • Inner Mongolia
      • Manchuria
    • Eastern Asia
      • Japan
      • Korea
    • Mongolia
      • Mongolia
    • Russian Far East
      • Amur
      • Kamchatka
      • Khabarovsk
      • Kuril Islands
      • Primorye
      • Sakhalin
    • Siberia
      • Chita

Links to other databases Top

Suggest others/fix!
Database ID/link to page
World Flora Online wfo-0000519124
Tropicos 50053157
KEW urn:lsid:ipni.org:names:708031-1
The Plant List kew-2620576
Missouri Botanical Garden 291420
Open Tree Of Life 512693
NCBI Taxonomy 64042
IPNI 708031-1
iNaturalist 742176
GBIF 5616565
EPPO AATSI
USDA GRIN 411898
Wikipedia Actaea_simplex
CMAUP NPO2727

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
A multi-center cross-sectional study of Chinese Herbal Medicine-Drug adverse reactions using active surveillance in Singapore’s Traditional Chinese Medicine clinics Ng CY, Zhao Y, Wang N, Chia KL, Teo CH, Peh W, Yeo P, Zhong LL Chin Med 07-Mar-2024
PMCID:PMC10918936
doi:10.1186/s13020-024-00915-z
PMID:38454483
A Narrative Review of the Herbal Preparation of Ayurvedic, Traditional Chinese, and Kampō Medicines Applied as Radioprotectors Ibáñez B, Melero A, Montoro A, Merino-Torres JF, Soriano JM, San Onofre N Antioxidants (Basel) 17-Jul-2023
PMCID:PMC10376155
doi:10.3390/antiox12071437
PMID:37507975
Comparative study of the effects of the three kinds of Kampo-hozai: Ninjinyoeito, Hochuekkito, and Juzentaihoto on anxious and low sociability behavior using NPY-knockout zebrafish Kawabe M, Nishida T, Takahashi R, Inui A, Shiozaki K Front Pharmacol 30-May-2023
PMCID:PMC10267730
doi:10.3389/fphar.2023.1168229
PMID:37324500
Anxiolytic-like effects of hochuekkito in lipopolysaccharide-treated mice involve interleukin-6 inhibition Ushio S, Wada Y, Nakamura M, Matsumoto D, Hoshika K, Shiromizu S, Iwata N, Esumi S, Kajizono M, Kitamura Y, Sendo T Front Pharmacol 12-Aug-2022
PMCID:PMC9411515
doi:10.3389/fphar.2022.890048
PMID:36034871
Paving the way towards effective plant-based inhibitors of hyaluronidase and tyrosinase: a critical review on a structure–activity relationship Gębalski J, Graczyk F, Załuski D J Enzyme Inhib Med Chem 26-Apr-2022
PMCID:PMC9045780
doi:10.1080/14756366.2022.2061966
PMID:35470749
Benefits of Black Cohosh (Cimicifuga racemosa) for Women Health: An Up-Close and In-Depth Review Mohapatra S, Iqubal A, Ansari MJ, Jan B, Zahiruddin S, Mirza MA, Ahmad S, Iqbal Z Pharmaceuticals (Basel) 23-Feb-2022
PMCID:PMC8953734
doi:10.3390/ph15030278
PMID:35337076
Effects of Hochuekkito, a traditional Japanese medicine (Kampo), on reproduction of aging female mice Vo KC, Sato Y, Kawagoe Y, Kawamura K Reprod Med Biol 10-Nov-2021
PMCID:PMC8658873
doi:10.1002/rmb2.12425
PMID:34938149
Stagonosporopsis pogostemonis: A Novel Ascomycete Fungus Causing Leaf Spot and Stem Blight on Pogostemon cablin (Lamiaceae) in South China Dong ZY, Huang YH, Manawasinghe IS, Wanasinghe DN, Liu JW, Shu YX, Zhao MP, Xiang MM, Luo M Pathogens 27-Aug-2021
PMCID:PMC8465882
doi:10.3390/pathogens10091093
PMID:34578126
Hochuekkito can Prevent the Colonization of Methicillin-Resistant Staphylococcus aureus in Upper Respiratory Tract of Acute Stroke Patients Kitahara M, Takayama S, Akaishi T, Kikuchi A, Ishii T Front Pharmacol 28-Jun-2021
PMCID:PMC8273298
doi:10.3389/fphar.2021.683171
PMID:34262453
Antitumor Profile of Carbon-Bridged Steroids (CBS) and Triterpenoids Dembitsky VM, Gloriozova TA, Poroikov VV Mar Drugs 03-Jun-2021
PMCID:PMC8228860
doi:10.3390/md19060324
PMID:34205074
Intraspecific convergence of floral size correlates with pollinator size on different mountains: a case study of a bumblebee-pollinated Lamium (Lamiaceae) flowers in Japan Toji T, Ishimoto N, Egawa S, Nakase Y, Hattori M, Itino T BMC Ecol Evol 24-Apr-2021
PMCID:PMC8067403
doi:10.1186/s12862-021-01796-8
PMID:33894742
Taxonomy and phylogeny of the Erysiphe lonicerae complex (Helotiales, Erysiphaceae) on Lonicera spp. Bradshaw M, Braun U, Götz M, Takamatsu S Fungal Syst Evol 26-Nov-2020
PMCID:PMC8165964
doi:10.3114/fuse.2021.07.03
PMID:34124617
Comparative Analysis of Actaea Chloroplast Genomes and Molecular Marker Development for the Identification of Authentic Cimicifugae Rhizoma Park I, Song JH, Yang S, Moon BC Plants (Basel) 27-Jan-2020
PMCID:PMC7076663
doi:10.3390/plants9020157
PMID:32012666
Hochu-Ekki-To Improves Motor Function in an Amyotrophic Lateral Sclerosis Animal Model Cai M, Yang EJ Nutrients 04-Nov-2019
PMCID:PMC6893748
doi:10.3390/nu11112644
PMID:31689925
The speciation history of northern‐ and southern‐sourced Eranthis (Ranunculaceae) species on the Korean peninsula and surrounding areas Oh A, Oh B Ecol Evol 14-Feb-2019
PMCID:PMC6405485
doi:10.1002/ece3.4969
PMID:30891225

Phytochemical Profile Top

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Below are displayed the proven (via scientific papers) natural compounds!
You can also contribute to this by clicking here.
Name PubChem ID Canonical SMILES MW Found in Proof
> 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
Phenylethyl Alcohol 6054 Click to see C1=CC=C(C=C1)CCO 122.16 unknown https://doi.org/10.1016/0305-1978(87)90058-5
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acid esters
Methyl benzoate 7150 Click to see COC(=O)C1=CC=CC=C1 136.15 unknown https://doi.org/10.1016/0305-1978(87)90058-5
> 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 https://doi.org/10.1016/0305-1978(87)90058-5
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Salicylic acid and derivatives / Salicylic acids
Salicylic Acid 338 Click to see C1=CC=C(C(=C1)C(=O)O)O 138.12 unknown via CMAUP database
> 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
> 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 / 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 / Phenyl methylcarbamates
5-Dimethylamino-4-tolyl methylcarbamate 26479 Click to see CC1=C(C=C(C=C1)OC(=O)NC)N(C)C 208.26 unknown via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Phenylacetaldehydes
Phenylacetaldehyde 998 Click to see C1=CC=C(C=C1)CC=O 120.15 unknown via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Phenylpropanes
2-(4-Methylphenyl)propan-2-ol 14529 Click to see CC1=CC=C(C=C1)C(C)(C)O 150.22 unknown via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Styrenes
Benzene, propenyl- 12500 Click to see CC=CC1=CC=CC=C1 118.18 unknown https://doi.org/10.1016/0305-1978(87)90058-5
> Benzenoids / Phenanthrenes and derivatives
Phenanthrene 995 Click to see C1=CC=C2C(=C1)C=CC3=CC=CC=C32 178.23 unknown via CMAUP database
> Benzenoids / Phenol ethers / Anisoles
Anethole 637563 Click to see CC=CC1=CC=C(C=C1)OC 148.20 unknown via CMAUP database
Anethole, (Z)- 1549040 Click to see CC=CC1=CC=C(C=C1)OC 148.20 unknown via CMAUP database
Elemicin 10248 Click to see COC1=CC(=CC(=C1OC)OC)CC=C 208.25 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 / Cresols / Ortho cresols
o-Cresol 335 Click to see CC1=CC=CC=C1O 108.14 unknown via CMAUP database
> Benzenoids / Phenols / Cresols / Para cresols
P-Cresol 2879 Click to see CC1=CC=C(C=C1)O 108.14 unknown via CMAUP database
> Benzenoids / Phenols / Methoxyphenols
Eugenol 3314 Click to see COC1=C(C=CC(=C1)CC=C)O 164.20 unknown via CMAUP database
Guaiacol 460 Click to see COC1=CC=CC=C1O 124.14 unknown via CMAUP database
Isoeugenol 853433 Click to see CC=CC1=CC(=C(C=C1)O)OC 164.20 unknown https://doi.org/10.1016/0305-1978(87)90058-5
> Hydrocarbons / Polycyclic hydrocarbons
Perhydropyrene 75524 Click to see C1CC2CCC3CCCC4C3C2C(C1)CC4 218.38 unknown via CMAUP database
> Hydrocarbons / Saturated hydrocarbons / Alkanes
Hexacosane 12407 Click to see CCCCCCCCCCCCCCCCCCCCCCCCCC 366.70 unknown via CMAUP database
Pentacosane 12406 Click to see CCCCCCCCCCCCCCCCCCCCCCCCC 352.70 unknown via CMAUP database
Pentadecane 12391 Click to see CCCCCCCCCCCCCCC 212.41 unknown via CMAUP database
Tricosane 12534 Click to see CCCCCCCCCCCCCCCCCCCCCCC 324.60 unknown via CMAUP database
> 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
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Branched fatty acids / Methyl-branched fatty acids
3-Methyl crotonic acid 10931 Click to see CC(=CC(=O)O)C 100.12 unknown via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids
Myristic Acid 11005 Click to see CCCCCCCCCCCCCC(=O)O 228.37 unknown via CMAUP database
Palmitic Acid 985 Click to see CCCCCCCCCCCCCCCC(=O)O 256.42 unknown via CMAUP database
Pentadecanoic acid 13849 Click to see CCCCCCCCCCCCCCC(=O)O 242.40 unknown via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Medium-chain fatty acids
Caproic Acid 8892 Click to see CCCCCC(=O)O 116.16 unknown https://doi.org/10.1080/14786410500182037
Heptanoic Acid 8094 Click to see CCCCCCC(=O)O 130.18 unknown via CMAUP database
Lauric Acid 3893 Click to see CCCCCCCCCCCC(=O)O 200.32 unknown via CMAUP database
Nonanoic acid 8158 Click to see CCCCCCCCC(=O)O 158.24 unknown via CMAUP database
Octanoic acid 379 Click to see CCCCCCCC(=O)O 144.21 unknown via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Straight chain fatty acids
Valeric acid 7991 Click to see CCCCC(=O)O 102.13 unknown via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols
(S)-(+)-2-Octanol 2723888 Click to see CCCCCCC(C)O 130.23 unknown via CMAUP database
1-Octanol 957 Click to see CCCCCCCCO 130.23 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids
(E)-2,6,10-Trimethylundeca-5,9-dienol 6364638 Click to see CC(CCC=C(C)CCC=C(C)C)CO 210.36 unknown via CMAUP database
beta-Ocimene, (3Z)- 5320250 Click to see CC(=CCC=C(C)C=C)C 136.23 unknown https://doi.org/10.1016/0305-1978(87)90058-5
Citral 638011 Click to see CC(=CCCC(=CC=O)C)C 152.23 unknown via CMAUP database
Geraniol 637566 Click to see CC(=CCCC(=CCO)C)C 154.25 unknown via CMAUP database
Geranylacetone 1549778 Click to see CC(=CCCC(=CCCC(=O)C)C)C 194.31 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 CC(=CCCC(C)(C=C)O)C 154.25 unknown via CMAUP database
Linalool, (+/-)- 6549 Click to see CC(=CCCC(C)(C=C)O)C 154.25 unknown https://doi.org/10.1016/0305-1978(87)90058-5
Neral 643779 Click to see CC(=CCCC(=CC=O)C)C 152.23 unknown via CMAUP database
Nerol 643820 Click to see CC(=CCCC(=CCO)C)C 154.25 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids
(-)-(1S,4S)-Borneol 6850744 Click to see CC1(C2CCC1(C(C2)O)C)C 154.25 unknown via CMAUP database
(1R,2S,4R)-Borneol 439568 Click to see CC1(C2CCC1(C(C2)O)C)C 154.25 unknown via CMAUP database
(1S-endo)-1,7,7-trimethylbicyclo(2.2.1)heptan-2-ol 10049 Click to see CC1(C2CCC1(C(C2)O)C)C 154.25 unknown via CMAUP database
(1S,2S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol 12242815 Click to see CC1(C2CCC1(C(C2)O)C)C 154.25 unknown via CMAUP database
1,7,7-Trimethylbicyclo[2.2.1]heptan-2-ol 64685 Click to see CC1(C2CCC1(C(C2)O)C)C 154.25 unknown via CMAUP database
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
Borneo camphor 12242824 Click to see CC1(C2CCC1(C(C2)O)C)C 154.25 unknown via CMAUP database
Borneol 6552009 Click to see CC1(C2CCC1(C(C2)O)C)C 154.25 unknown via CMAUP database
Borneol, (-)- 1201518 Click to see CC1(C2CCC1(C(C2)O)C)C 154.25 unknown via CMAUP database
Camphene 6616 Click to see CC1(C2CCC(C2)C1=C)C 136.23 unknown https://doi.org/10.1016/0305-1978(87)90058-5
DL-Borneol 10492 Click to see CC1(C2CCC1(C(C2)O)C)C 154.25 unknown via CMAUP database
Nopinone 10313167 Click to see CC1(C2CCC(=O)C1C2)C 138.21 unknown via CMAUP database
Sumatra camphor 657014 Click to see CC1(C2CCC1(C(C2)O)C)C 154.25 unknown via CMAUP database
trans-Borneol 44630107 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
(-)-alpha-Terpineol 443162 Click to see CC1=CCC(CC1)C(C)(C)O 154.25 unknown via CMAUP database
(-)-Pulegone 638012 Click to see CC1CCC(=C(C)C)C(=O)C1 152.23 unknown via CMAUP database
(+) Menthol 12285346 Click to see CC1CCC(C(C1)O)C(C)C 156.26 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 CC1CCC(C(=O)C1)C(C)C 154.25 unknown via CMAUP database
(+)-Neomenthol 439263 Click to see CC1CCC(C(C1)O)C(C)C 156.26 unknown via CMAUP database
Alpha-Terpineol 17100 Click to see CC1=CCC(CC1)C(C)(C)O 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, (+/-)- 22311 Click to see CC1=CCC(CC1)C(=C)C 136.23 unknown https://doi.org/10.1016/0305-1978(87)90058-5
Menthol 1254 Click to see CC1CCC(C(C1)O)C(C)C 156.26 unknown via CMAUP database
Menthone 26447 Click to see CC1CCC(C(=O)C1)C(C)C 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 CC1CCC(C(=O)C1)C(C)C 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
(+)-Nerolidol 5356544 Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C 222.37 unknown via CMAUP database
(1S,2R,3R,7S,9S,12S,17R,18R,19R)-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24,25-trioxaheptacyclo[19.2.1.19,12.01,18.03,17.04,14.07,12]pentacos-4(14)-en-2-ol 101593158 Click to see CC1CC2C(OC3(C1C4(CCC5=C(C4(C3O)C)CCC6C(C7CCC6(C5)O7)(C)C)C)O2)C(C)(C)O 486.70 unknown via CMAUP database
(3R,6E)-nerolidol 11241545 Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C 222.37 unknown via CMAUP database
(3S,6E)-Nerolidol 5281525 Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C 222.37 unknown via CMAUP database
1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, (3R,6Z)- 12227246 Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C 222.37 unknown via CMAUP database
24-O-Acetylacerionol 101596791 Click to see CC1CC(OC2C1C3(CCC4=C(C3(C2=O)C)CCC5C(C6CCC5(C4)O6)(C)C)C)C(C(C)(C)O)OC(=O)C 528.70 unknown via CMAUP database
6,10,14-Trimethylpentadecan-2-one 10408 Click to see CC(C)CCCC(C)CCCC(C)CCCC(=O)C 268.50 unknown via CMAUP database
Acerinol 73347277 Click to see CC1CC2C(OC3(C1C4(CCC5=C(C4(C3O)C)CCC6C(C7CCC6(C5)O7)(C)C)C)O2)C(C)(C)O 486.70 unknown via CMAUP database
Acerionol 101593159 Click to see CC1CC(OC2C1C3(CCC4=C(C3(C2=O)C)CCC5C(C6CCC5(C4)O6)(C)C)C)C(C(C)(C)O)O 486.70 unknown via CMAUP database
Caryophyllene 5281515 Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C 204.35 unknown https://doi.org/10.1016/0305-1978(87)90058-5
Caryophyllene,alpha + beta mixt. 5354499 Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C 204.35 unknown https://doi.org/10.1016/0305-1978(87)90058-5
CID 71448948 71448948 Click to see CC1CC2C(OC3(C1C4(CCC5=C(C4(C3O)C)CCC6C(C7CCC6(C5)O7)(C)C)C)O2)C(C)(C)O 486.70 unknown via CMAUP database
cis-Nerolidol 5320128 Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C 222.37 unknown via CMAUP database
Humulene 5281520 Click to see CC1=CCC(C=CCC(=CCC1)C)(C)C 204.35 unknown https://doi.org/10.1016/0305-1978(87)90058-5
Nerolidol 8888 Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C 222.37 unknown via CMAUP database
trans-Nerolidol 5284507 Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C 222.37 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eremophilane, 8,9-secoeremophilane and furoeremophilane sesquiterpenoids
Atractylol 5321065 Click to see CC1=COC2=C1CC3C(=C)CCCC3(C2)C 216.32 unknown https://doi.org/10.1080/14786410500182037
Atractylon 3080635 Click to see CC1=COC2=C1CC3C(=C)CCCC3(C2)C 216.32 unknown https://doi.org/10.1080/14786410500182037
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eudesmane, isoeudesmane or cycloeudesmane sesquiterpenoids
2-(4a-Methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)propan-2-ol 521215 Click to see CC12CCCC(=C)C1CC(CC2)C(C)(C)O 222.37 unknown via CMAUP database
2-Naphthalenemethanol, decahydro-alpha,alpha,4a-trimethyl-8-methylene-, [2R-(2alpha,4aalpha,8abeta)]- 6432456 Click to see CC12CCCC(=C)C1CC(CC2)C(C)(C)O 222.37 unknown via CMAUP database
beta-EUDESMOL 91457 Click to see CC12CCCC(=C)C1CC(CC2)C(C)(C)O 222.37 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides
Peoniflorin 442534 Click to see CC12CC3(C4CC1(C4(C(O2)O3)COC(=O)C5=CC=CC=C5)OC6C(C(C(C(O6)CO)O)O)O)O 480.50 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Triterpene glycosides / Triterpene saponins
(1S,2R,3S,4R,5S,7R,9S,12R,14S,17R,18R,19R,21R,22S)-9-[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosane-2,5-diol 163103126 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CC(C6C4(C3O)C)O)(C)C)OC8C(C(C(O8)CO)O)O)C)O2)C(C)(C)O 636.80 unknown https://doi.org/10.1248/CPB.43.1167
(1S,2R,3S,4R,7R,9S,12R,14R,16R,17R,18R,19R,21R,22S)-9-[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosane-2,16-diol 162866555 Click to see CC1CC2C(OC3(C1C4(C(CC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(O8)CO)O)O)O)C)O2)C(C)(C)O 636.80 unknown https://doi.org/10.1248/CPB.43.1167
(1S,2R,3S,4R,7R,9S,12R,14R,16R,17R,18R,19R,21R,22S)-9-[(2R,3S,4S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosane-2,16-diol 162866554 Click to see CC1CC2C(OC3(C1C4(C(CC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(O8)CO)O)O)O)C)O2)C(C)(C)O 636.80 unknown https://doi.org/10.1248/CPB.43.1167
(2R,3R,4S,5R,6R)-2-[[(1S,2R,3R,7R,9S,12R,14R,17R,18R,19R,21R,22S)-2-hydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracos-4-en-9-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol 102600397 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CC=C6C4(C3O)C)(C)C)OC8C(C(C(C(O8)CO)O)O)O)C)O2)C(C)(C)O 648.80 unknown https://doi.org/10.1248/CPB.44.2078
(2R,3R,4S,5R,6R)-2-[[(1S,2R,3R,7S,9S,12R,14R,17R,18R,19R,21R,22S)-2-hydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracos-4-en-9-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol 162848809 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CC=C6C4(C3O)C)(C)C)OC8C(C(C(C(O8)CO)O)O)O)C)O2)C(C)(C)O 648.80 unknown https://doi.org/10.1248/CPB.47.511
[(1R,3R)-1-[(2S)-3,3-dimethyloxiran-2-yl]-3-[(1R,3R,6S,8R,12R,13R,15R,16R)-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl]butyl] acetate 100936538 Click to see CC(CC(C1C(O1)(C)C)OC(=O)C)C2C(=O)C(C3(C2(CCC45C3=CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(C(O7)CO)O)O)O)C)C)O 690.90 unknown https://doi.org/10.1248/CPB.47.511
[(1R)-1-[(1R,4R,5R,6R,8R,10R,11R,12R,16R,18S,21R)-10,11-dihydroxy-4,6,12,17,17-pentamethyl-18-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-en-8-yl]-2-hydroxy-2-methylpropyl] acetate 102600395 Click to see CC1CC(OC2(C1C3(CCC45CC46CCC(C(C6CC=C5C3(C2O)C)(C)C)OC7C(C(C(C(O7)CO)O)O)O)C)O)C(C(C)(C)O)OC(=O)C 708.90 unknown https://doi.org/10.1248/CPB.44.2078
https://doi.org/10.1248/CPB.47.511
[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2R,3S,4S,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] (1S,2R,4aS,6aR,6aS,6bR,8R,8aR,9R,10R,11R,12aR,14bS)-8,10,11-trihydroxy-9-(hydroxymethyl)-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylate 73415765 Click to see CC1CCC2(CCC3(C(=CCC4C3(CC(C5C4(CC(C(C5(C)CO)O)O)C)O)C)C2C1C)C)C(=O)OC6C(C(C(C(O6)COC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)C)O)O)O)O)O)O)O)O 975.10 unknown via CMAUP database
[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] (1S,2R,4aS,6aR,6aR,6bR,8R,8aR,9R,10R,11R,12aR,14bS)-8,10,11-trihydroxy-9-(hydroxymethyl)-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylate 45356919 Click to see CC1CCC2(CCC3(C(=CCC4C3(CC(C5C4(CC(C(C5(C)CO)O)O)C)O)C)C2C1C)C)C(=O)OC6C(C(C(C(O6)COC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)C)O)O)O)O)O)O)O)O 975.10 unknown via CMAUP database
[1-(3,3-Dimethyloxiran-2-yl)-3-[13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl]butyl] acetate 85193599 Click to see CC(CC(C1C(O1)(C)C)OC(=O)C)C2C(=O)C(C3(C2(CCC45C3=CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(C(O7)CO)O)O)O)C)C)O 690.90 unknown https://doi.org/10.1248/CPB.47.511
2-[(1S,2R,3S,4R,5S,7R,9S,12R,14S,17R,18R,19R,21R,22S)-9-[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-2,5-dihydroxy-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-22-yl]propan-2-yl acetate 162869510 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CC(C6C4(C3O)C)O)(C)C)OC8C(C(C(O8)CO)O)O)C)O2)C(C)(C)OC(=O)C 678.80 unknown https://doi.org/10.1248/CPB.43.1167
2-[9-[3,4-Dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-2,5-dihydroxy-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-22-yl]propan-2-yl acetate 162869509 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CC(C6C4(C3O)C)O)(C)C)OC8C(C(C(O8)CO)O)O)C)O2)C(C)(C)OC(=O)C 678.80 unknown https://doi.org/10.1248/CPB.43.1167
9-[3,4-Dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosane-2,16-diol 162866553 Click to see CC1CC2C(OC3(C1C4(C(CC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(O8)CO)O)O)O)C)O2)C(C)(C)O 636.80 unknown https://doi.org/10.1248/CPB.43.1167
9-[3,4-Dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosane-2,5-diol 163103125 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CC(C6C4(C3O)C)O)(C)C)OC8C(C(C(O8)CO)O)O)C)O2)C(C)(C)O 636.80 unknown https://doi.org/10.1248/CPB.43.1167
Madecassoside 24825675 Click to see CC1CCC2(CCC3(C(=CCC4C3(CC(C5C4(CC(C(C5(C)CO)O)O)C)O)C)C2C1C)C)C(=O)OC6C(C(C(C(O6)COC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)C)O)O)O)O)O)O)O)O 975.10 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
Cimicinol 102146755 Click to see CC1CC2C(OC3(C1C4(CC=C5CC6=CCC(C(C6CC=C5C4(C3)C)(C)C)OC7C(C(C(CO7)O)O)O)C)O2)C(C)(C)O 600.80 unknown via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Cycloartanols and derivatives
(1R,2R,3S,4R,7R,9S,12R,14S,17R,18R,19R,21R,22R)-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosane-2,9-diol 51346124 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)O)C)O2)C(C)(C)O 488.70 unknown via CMAUP database
(1R,3R,6S,8R,12R,15R,16R,18S)-15-[(2R,5R)-5,6-dihydroxy-6-methyl-4-oxoheptan-2-yl]-18-hydroxy-7,7,12,16-tetramethyl-6-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxypentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-en-14-one 24721385 Click to see CC(CC(=O)C(C(C)(C)O)O)C1C(=O)CC2(C1(CC(C34C2=CCC5C3(C4)CCC(C5(C)C)OC6C(C(C(CO6)O)O)O)O)C)C 634.80 unknown via CMAUP database
(1S,2S,3S,4R,7R,9S,12R,14S,17R,18R,19R,21R,22R)-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosane-2,9-diol 101596828 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)O)C)O2)C(C)(C)O 488.70 unknown via CMAUP database
(20S,22R,23R,24R)-3beta-(beta-D-Xylopyranosyloxy)-16beta,23:22,25-diepoxycycloarta-23,24-diol 21591252 Click to see CC1C2C(CC3(C2(CCC45C3CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)C)C)OC8(C1OC(C8O)(C)C)O 620.80 unknown https://doi.org/10.1016/S0031-9422(98)00407-5
(2R,3S,9S,12R,14S,17R,19R,22S)-22-(2-methoxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosane-2,9-diol 5319557 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)O)C)O2)C(C)(C)OC 502.70 unknown via CMAUP database
(2S,3R,4S,5R)-2-[(1'R,4'R,12'R,16'R,21'R)-2-hydroxy-1,4',6',12',17',17'-hexamethylspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-ene]-18'-yl]oxyoxane-3,4,5-triol 54750570 Click to see CC1CC2(C3C(O3)(C(O2)O)C)OC4C1C5(CCC67CC68CCC(C(C8CC=C7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)C 616.80 unknown via CMAUP database
(2S,3R,4S,5R)-2-[(1S,1'S,4R,4'R,5R,5'R,6'R,10'S,12'R,16'S,18'S,20'S,21'S)-2,20'-dihydroxy-1,4',6',12',17',17'-hexamethylspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-ene]-18'-yl]oxyoxane-3,4,5-triol 102120220 Click to see CC1CC2(C3C(O3)(C(O2)O)C)OC4C1C5(CCC67CC68C(CC=C7C5(C4)C)C(C(CC8O)OC9C(C(C(CO9)O)O)O)(C)C)C 632.80 unknown https://doi.org/10.1248/CPB.46.1001
(2S,3R,4S,5R)-2-[(1S,1'S,4R,4'R,5R,5'R,6'R,10'S,12'S,13'S,16'S,18'S,20'S,21'S)-2,20'-dihydroxy-1,4',6',12',17',17'-hexamethylspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosane]-18'-yl]oxyoxane-3,4,5-triol 102120221 Click to see CC1CC2(C3C(O3)(C(O2)O)C)OC4C1C5(CCC67CC68C(CCC7C5(C4)C)C(C(CC8O)OC9C(C(C(CO9)O)O)O)(C)C)C 634.80 unknown https://doi.org/10.1248/CPB.46.1001
(2S,3R,4S,5R)-2-[[(1S,2R,3R,7S,9S,12R,14R,17R,18R,19R,21R,22S)-2-hydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracos-4-en-9-yl]oxy]oxane-3,4,5-triol 162976747 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CC=C6C4(C3O)C)(C)C)OC8C(C(C(CO8)O)O)O)C)O2)C(C)(C)O 618.80 unknown https://doi.org/10.1248/CPB.47.511
(2S,3R,4S,5R)-2-[[(1S,2S,3R,7S,9S,12R,14R,17R,18R,19R,21R,22R)-2-hydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracos-4-en-9-yl]oxy]oxane-3,4,5-triol 162976752 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CC=C6C4(C3O)C)(C)C)OC8C(C(C(CO8)O)O)O)C)O2)C(C)(C)O 618.80 unknown https://doi.org/10.1248/CPB.47.511
(2S,3R,4S,5R)-2-[[(1S,2S,5R,7S,10R,12S,15R,16R,17S,18R,21R,22S,24S)-21,22-dihydroxy-1,6,6,15,17,20,20-heptamethyl-19,23-dioxaheptacyclo[13.10.0.02,12.05,10.010,12.016,24.018,22]pentacosan-7-yl]oxy]oxane-3,4,5-triol 101943862 Click to see CC1C2C(CC3(C2(CCC45C3CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)C)C)OC8(C1OC(C8O)(C)C)O 620.80 unknown https://doi.org/10.3987/COM-98-8121
(2S,3R,4S,5R)-2-{[(4aR,5'R,5aS,7aR,7bR,10S,11aS,12aS,12bS,14aR)-4'-hydroxy-1,1,5',7a,8,12a-hexamethylhexadecahydro-2H-spiro[cyclopropa[1',8a']naphtho[2',1':4,5]indeno[2,1-b]pyran-10,2'-[3,6]dioxabicyclo[3.1.0]hexan]-2-yl]oxy}tetrahydro-2H-pyran-3,4,5-trio 6537491 Click to see CC1CC2(C3C(O3)(C(O2)O)C)OC4C1C5(CCC67CC68CCC(C(C8CCC7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)C 618.80 unknown https://doi.org/10.1248/CPB.43.771
(2S,3R,4S,5R)-2-{[(4aR,5aR,7aR,8R,12aR,14aR)-4'-hydroxy-1,1,5',7a,8,12a-hexamethyl-1,3,4,6,7,7a,7b,8,9,11a,12,12a,14,14a-tetradecahydro-2H-spiro[cyclopropa[1',8a']naphtho[2',1':4,5]indeno[2,1-b]pyran-10,2'-[3,6]dioxabicyclo[3.1.0]hexan]-2-yl]oxy}tetrahydr 6537499 Click to see CC1CC2(C3C(O3)(C(O2)O)C)OC4C1C5(CCC67CC68CCC(C(C8CC=C7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)C 616.80 unknown https://doi.org/10.1248/CPB.46.467
https://doi.org/10.1248/YAKUSHI1947.103.3_293
(2S,3R,4S,5S)-2-[[(1S,2R,3R,7S,9S,12R,14R,17R,18R,19R,21R,22S)-2-hydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracos-4-en-9-yl]oxy]oxane-3,4,5-triol 163186526 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CC=C6C4(C3O)C)(C)C)OC8C(C(C(CO8)O)O)O)C)O2)C(C)(C)O 618.80 unknown https://doi.org/10.1248/CPB.47.511
(2S,3R,4S,5S)-2-[[(1S,2R,3S,7R,9S,12R,14S,16R,17R,18R,19R,21R,22S)-2,16-dihydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracos-4-en-9-yl]oxy]oxane-3,4,5-triol 162842895 Click to see CC1CC2C(OC3(C1C4(C(CC56CC57CCC(C(C7CC=C6C4(C3O)C)(C)C)OC8C(C(C(CO8)O)O)O)O)C)O2)C(C)(C)O 634.80 unknown https://doi.org/10.1248/CPB.49.437
https://doi.org/10.1248/BPB.24.1198
(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 145925700 Click to see CC(CCC=C(C)C)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)O)C)C 426.70 unknown https://doi.org/10.1248/CPB.47.1157
[(1'R,3'R,4'R,5'R,6'R,12'S,13'S,16'R,18'S,21'R)-1,4',6',12',17',17'-hexamethyl-18'-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosane]-3'-yl] acetate 101081787 Click to see CC1CC2(C3C(O3)(CO2)C)OC4C1C5(C(CC67CC68CCC(C(C8CCC7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)OC(=O)C)C 660.80 unknown via CMAUP database
[(1'R,3'R,4'R,5'R,6'R,12'S,13'S,16'R,18'S,21'R)-18'-[(2S,3R,4S,5R)-3-acetyloxy-4,5-dihydroxyoxan-2-yl]oxy-2-hydroxy-1,4',6',12',17',17'-hexamethylspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosane]-3'-yl] acetate 101110571 Click to see CC1CC2(C3C(O3)(C(O2)O)C)OC4C1C5(C(CC67CC68CCC(C(C8CCC7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)OC(=O)C)OC(=O)C)C 718.90 unknown via CMAUP database
[(1R,1'S,4S,4'R,5R,5'R,6'R,10'S,12'R,16'S,18'S,20'R,21'S)-1,4',6',12',17',17'-hexamethyl-18'-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-ene]-20'-yl] acetate 163006957 Click to see CC1CC2(C3C(O3)(CO2)C)OC4C1C5(CCC67CC68C(CC=C7C5(C4)C)C(C(CC8OC(=O)C)OC9C(C(C(CO9)O)O)O)(C)C)C 658.80 unknown https://doi.org/10.1248/CPB.47.511
[(1R,3R)-1-[(2R)-3,3-dimethyloxiran-2-yl]-3-[(1S,3R,6S,8R,11R,12S,13R,15R,16R)-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]butyl] acetate 53326834 Click to see CC(CC(C1C(O1)(C)C)OC(=O)C)C2C(=O)C(C3(C2(CCC45C3CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)C)C)O 662.80 unknown https://doi.org/10.1248/CPB.42.1940
[(1R,3R)-1-[(2S)-3,3-dimethyloxiran-2-yl]-3-[(1R,3R,6S,8R,12R,13R,15R,16R)-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl]butyl] acetate 102179089 Click to see CC(CC(C1C(O1)(C)C)OC(=O)C)C2C(=O)C(C3(C2(CCC45C3=CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)C)C)O 660.80 unknown https://doi.org/10.1248/CPB.47.1175
[(1R,3R)-3-[(1S,3R,6S,8R,10S,11R,12S,13R,15R,16R)-10,13-dihydroxy-7,7,12,16-tetramethyl-14-oxo-6-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-1-[(2S)-3,3-dimethyloxiran-2-yl]butyl] acetate 163010237 Click to see CC(CC(C1C(O1)(C)C)OC(=O)C)C2C(=O)C(C3(C2(CCC45C3C(CC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)O)C)C)O 678.80 unknown https://doi.org/10.1248/CPB.42.1106
[(1R,3R)-3-[(1S,3R,6S,8R,11R,12S,13R,15R,16R)-6-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-1-[(2R)-3,3-dimethyloxiran-2-yl]butyl] acetate 10440478 Click to see CC(CC(C1C(O1)(C)C)OC(=O)C)C2C(=O)C(C3(C2(CCC45C3CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)OC8C(C(C(C(O8)CO)O)O)O)O)C)C)O 825.00 unknown https://doi.org/10.1248/CPB.42.1940
[(1R,3R)-3-[(1S,3S,4S,6S,8S,11R,12S,13R,15R,16R)-4,13-dihydroxy-7,7,12,16-tetramethyl-14-oxo-6-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-1-[(2R)-3,3-dimethyloxiran-2-yl]butyl] acetate 163186918 Click to see CC(CC(C1C(O1)(C)C)OC(=O)C)C2C(=O)C(C3(C2(CCC45C3CCC6C4(C5)C(CC(C6(C)C)OC7C(C(C(CO7)O)O)O)O)C)C)O 678.80 unknown https://doi.org/10.1248/CPB.43.279
[(1R)-1-[(1R,4R,5R,6R,8R,10R,11R,12R,16R,18S,21R)-10,11-dihydroxy-4,6,12,17,17-pentamethyl-18-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-en-8-yl]-2-hydroxy-2-methylpropyl] acetate 100936502 Click to see CC1CC(OC2(C1C3(CCC45CC46CCC(C(C6CC=C5C3(C2O)C)(C)C)OC7C(C(C(CO7)O)O)O)C)O)C(C(C)(C)O)OC(=O)C 678.80 unknown https://doi.org/10.1248/CPB.47.511
[(1R)-1-[(1R,4R,5R,6R,8R,10R,11R,12R,16R,18S,21R)-10,11-dihydroxy-4,6,12,17,17-pentamethyl-18-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-en-8-yl]-2-hydroxy-2-methylpropyl] acetate 100936496 Click to see CC1CC(OC2(C1C3(CCC45CC46CCC(C(C6CC=C5C3(C2O)C)(C)C)OC7C(C(C(CO7)O)O)O)C)O)C(C(C)(C)O)OC(=O)C 678.80 unknown https://doi.org/10.1248/CPB.47.511
[(1S,1'R,2S,3'R,4R,4'R,5S,5'R,6'R,10'S,12'S,13'S,16'R,18'S,21'R)-2-hydroxy-1,4',6',12',17',17'-hexamethyl-18'-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosane]-3'-yl] acetate 53325243 Click to see CC1CC2(C3C(O3)(C(O2)O)C)OC4C1C5(C(CC67CC68CCC(C(C8CCC7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)OC(=O)C)C 676.80 unknown via CMAUP database
[(1S,1'R,3'R,4R,4'R,5S,5'R,6'R,12'S,13'S,16'R,18'S,21'R)-1,4',6',12',17',17'-hexamethyl-18'-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosane]-3'-yl] acetate 101182169 Click to see CC1CC2(C3C(O3)(CO2)C)OC4C1C5(C(CC67CC68CCC(C(C8CCC7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)OC(=O)C)C 660.80 unknown via CMAUP database
[(1S,1'R,4R,4'R,5'R,10'S,12'S,13'S,16'R,21'R)-2-hydroxy-1,4',6',12',17',17'-hexamethyl-18'-[(2S)-3,4,5-trihydroxyoxan-2-yl]oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosane]-3'-yl] acetate 137705962 Click to see CC1CC2(C3C(O3)(C(O2)O)C)OC4C1C5(C(CC67CC68CCC(C(C8CCC7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)OC(=O)C)C 676.80 unknown https://doi.org/10.1248/CPB.43.771
[(1S,1'S,2R,3'R,4R,4'R,5R,5'R,6'R,10'S,12'S,18'S,21'R)-2-methoxy-1,4',6',12',17',17'-hexamethyl-18'-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-ene]-3'-yl] acetate 10818396 Click to see CC1CC2(C3C(O3)(C(O2)OC)C)OC4C1C5(C(CC67CC68CCC(C(C8CC=C7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)OC(=O)C)C 688.80 unknown via CMAUP database
[(1S,1'S,2S,3'R,4R,4'R,5R,5'R,6'R,10'S,12'S,16'R,18'S,21'R)-2-hydroxy-1,4',6',12',17',17'-hexamethyl-18'-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-ene]-3'-yl] acetate 102004880 Click to see CC1CC2(C3C(O3)(C(O2)O)C)OC4C1C5(C(CC67CC68CCC(C(C8CC=C7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)OC(=O)C)C 674.80 unknown via CMAUP database
[(1S,3'S,4R,4'R,5R,5'R,6'R,10'S,12'S,16'R,18'R,21'R)-2-hydroxy-1,4',6',12',17',17'-hexamethyl-18'-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-ene]-3'-yl] acetate 139035030 Click to see CC1CC2(C3C(O3)(C(O2)O)C)OC4C1C5(C(CC67CC68CCC(C(C8CC=C7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)OC(=O)C)C 674.80 unknown https://doi.org/10.1248/CPB.46.467
https://doi.org/10.1248/YAKUSHI1947.103.3_293
[(1S,3R,6R,8R,12S,13R,15R,16R,17R)-15-[(2R,5R)-5,6-dihydroxy-6-methyl-4-oxoheptan-2-yl]-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-17-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl] acetate 162908290 Click to see CC(CC(=O)C(C(C)(C)O)O)C1C(=O)C(C2(C1(C(CC34C2=CCC5C3(C4)CCC(C5(C)C)OC6C(C(C(CO6)O)O)O)OC(=O)C)C)C)O 692.80 unknown https://doi.org/10.1248/BPB.24.1198
[(1S,3R,6R,8R,12S,13R,15R,16R,17R)-15-[(2R)-4-[(2R)-3,3-dimethyloxiran-2-yl]-4-oxobutan-2-yl]-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-17-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl] acetate 162843797 Click to see CC(CC(=O)C1C(O1)(C)C)C2C(=O)C(C3(C2(C(CC45C3=CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)OC(=O)C)C)C)O 674.80 unknown https://doi.org/10.1248/BPB.24.1198
[(1S,3R,6S,8R,12S,15R,16R,17R)-15-[(2R)-4-[(2S)-3,3-dimethyloxiran-2-yl]-4-oxobutan-2-yl]-7,7,12,16-tetramethyl-14-oxo-6-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-17-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl] acetate 162968489 Click to see CC(CC(=O)C1C(O1)(C)C)C2C(=O)CC3(C2(C(CC45C3=CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)OC(=O)C)C)C 658.80 unknown https://doi.org/10.1248/BPB.24.1198
[(1S)-1-[(1R,4R,5R,6R,8R,10R,11R,12R,16R,18S,21R)-10,11-dihydroxy-4,6,12,17,17-pentamethyl-18-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-en-8-yl]-2-hydroxy-2-methylpropyl] acetate 100936497 Click to see CC1CC(OC2(C1C3(CCC45CC46CCC(C(C6CC=C5C3(C2O)C)(C)C)OC7C(C(C(CO7)O)O)O)C)O)C(C(C)(C)O)OC(=O)C 678.80 unknown https://doi.org/10.1248/CPB.47.511
[(1S)-1-[(1R,4R,5R,6R,8R,10R,11R,12R,16R,18S,21R)-10,11-dihydroxy-4,6,12,17,17-pentamethyl-18-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-en-8-yl]-2-hydroxy-2-methylpropyl] acetate 100936499 Click to see CC1CC(OC2(C1C3(CCC45CC46CCC(C(C6CC=C5C3(C2O)C)(C)C)OC7C(C(C(CO7)O)O)O)C)O)C(C(C)(C)O)OC(=O)C 678.80 unknown https://doi.org/10.1248/CPB.47.511
[(1S)-1-[(1R,4R,5R,6R,8S,10R,11R,12R,16S,18S,21R)-10,11-dihydroxy-4,6,12,17,17-pentamethyl-18-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-en-8-yl]-2-methoxy-2-methylpropyl] acetate 162919959 Click to see CC1CC(OC2(C1C3(CCC45CC46CCC(C(C6CC=C5C3(C2O)C)(C)C)OC7C(C(C(CO7)O)O)O)C)O)C(C(C)(C)OC)OC(=O)C 692.90 unknown https://doi.org/10.1248/CPB.47.1175
[1-(3,3-Dimethyloxiran-2-yl)-3-[13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-(3,4,5-trihydroxyoxan-2-yl)oxy-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl]butyl] acetate 85174914 Click to see CC(CC(C1C(O1)(C)C)OC(=O)C)C2C(=O)C(C3(C2(CCC45C3=CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)C)C)O 660.80 unknown https://doi.org/10.1248/CPB.44.2078
https://doi.org/10.1248/CPB.47.1175
[1-[10,11-Dihydroxy-4,6,12,17,17-pentamethyl-18-(3,4,5-trihydroxyoxan-2-yl)oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-en-8-yl]-2-hydroxy-2-methylpropyl] acetate 75111071 Click to see CC1CC(OC2(C1C3(CCC45CC46CCC(C(C6CC=C5C3(C2O)C)(C)C)OC7C(C(C(CO7)O)O)O)C)O)C(C(C)(C)O)OC(=O)C 678.80 unknown https://doi.org/10.1248/CPB.47.511
[1-[10,11-Dihydroxy-4,6,12,17,17-pentamethyl-18-(3,4,5-trihydroxyoxan-2-yl)oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-en-8-yl]-2-methoxy-2-methylpropyl] acetate 85278634 Click to see CC1CC(OC2(C1C3(CCC45CC46CCC(C(C6CC=C5C3(C2O)C)(C)C)OC7C(C(C(CO7)O)O)O)C)O)C(C(C)(C)OC)OC(=O)C 692.90 unknown https://doi.org/10.1248/CPB.47.1175
[1,4',6',12',17',17'-Hexamethyl-18'-(3,4,5-trihydroxyoxan-2-yl)oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-ene]-20'-yl] acetate 163006956 Click to see CC1CC2(C3C(O3)(CO2)C)OC4C1C5(CCC67CC68C(CC=C7C5(C4)C)C(C(CC8OC(=O)C)OC9C(C(C(CO9)O)O)O)(C)C)C 658.80 unknown https://doi.org/10.1248/CPB.47.511
[1,4',6',12',17',17'-Hexamethyl-18'-(3,4,5-trihydroxyoxan-2-yl)oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosane]-3'-yl] acetate 73079472 Click to see CC1CC2(C3C(O3)(CO2)C)OC4C1C5(C(CC67CC68CCC(C(C8CCC7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)OC(=O)C)C 660.80 unknown via CMAUP database
[15-(5,6-Dihydroxy-6-methyl-4-oxoheptan-2-yl)-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-(3,4,5-trihydroxyoxan-2-yl)oxy-17-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl] acetate 85229043 Click to see CC(CC(=O)C(C(C)(C)O)O)C1C(=O)C(C2(C1(C(CC34C2=CCC5C3(C4)CCC(C5(C)C)OC6C(C(C(CO6)O)O)O)OC(=O)C)C)C)O 692.80 unknown https://doi.org/10.1248/CPB.49.437
[15-[4-(3,3-Dimethyloxiran-2-yl)-4-oxobutan-2-yl]-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-(3,4,5-trihydroxyoxan-2-yl)oxy-17-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl] acetate 85165371 Click to see CC(CC(=O)C1C(O1)(C)C)C2C(=O)C(C3(C2(C(CC45C3=CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)OC(=O)C)C)C)O 674.80 unknown https://doi.org/10.1248/CPB.49.437
[15-[4-(3,3-Dimethyloxiran-2-yl)-4-oxobutan-2-yl]-7,7,12,16-tetramethyl-14-oxo-6-(3,4,5-trihydroxyoxan-2-yl)oxy-17-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl] acetate 162968484 Click to see CC(CC(=O)C1C(O1)(C)C)C2C(=O)CC3(C2(C(CC45C3=CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)OC(=O)C)C)C 658.80 unknown https://doi.org/10.1248/CPB.49.437
[2-Hydroxy-1,4',6',12',17',17'-hexamethyl-18'-(3,4,5-trihydroxyoxan-2-yl)oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosane]-3'-yl] acetate 15558324 Click to see CC1CC2(C3C(O3)(C(O2)O)C)OC4C1C5(C(CC67CC68CCC(C(C8CCC7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)OC(=O)C)C 676.80 unknown via CMAUP database
[3-[10,13-Dihydroxy-7,7,12,16-tetramethyl-14-oxo-6-(3,4,5-trihydroxyoxan-2-yl)oxy-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-1-(3,3-dimethyloxiran-2-yl)butyl] acetate 85084053 Click to see CC(CC(C1C(O1)(C)C)OC(=O)C)C2C(=O)C(C3(C2(CCC45C3C(CC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)O)C)C)O 678.80 unknown https://doi.org/10.1248/CPB.42.1106
[3-[4,13-Dihydroxy-7,7,12,16-tetramethyl-14-oxo-6-(3,4,5-trihydroxyoxan-2-yl)oxy-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-1-(3,3-dimethyloxiran-2-yl)butyl] acetate 85084052 Click to see CC(CC(C1C(O1)(C)C)OC(=O)C)C2C(=O)C(C3(C2(CCC45C3CCC6C4(C5)C(CC(C6(C)C)OC7C(C(C(CO7)O)O)O)O)C)C)O 678.80 unknown https://doi.org/10.1248/CPB.43.279
[3-[6-[3,5-Dihydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-1-(3,3-dimethyloxiran-2-yl)butyl] acetate 85143964 Click to see CC(CC(C1C(O1)(C)C)OC(=O)C)C2C(=O)C(C3(C2(CCC45C3CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)OC8C(C(C(C(O8)CO)O)O)O)O)C)C)O 825.00 unknown https://doi.org/10.1248/CPB.42.1940
11-(2-Hydroxypropan-2-yl)-1,1,7a,8,13a-pentamethyloctadecahydro-5H-10,12a-epoxycyclopropa[1',8a']naphtho[2',1':4,5]indeno[2,1-b]oxepine-2,13-diol 23504335 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)O)C)O2)C(C)(C)O 488.70 unknown via CMAUP database
2-[(1S,2S,3R,7S,9S,12R,14R,17R,18R,19R,21R,22S)-2-hydroxy-3,8,8,17,19-pentamethyl-9-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracos-4-en-22-yl]propan-2-yl acetate 163080943 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CC=C6C4(C3O)C)(C)C)OC8C(C(C(CO8)O)O)O)C)O2)C(C)(C)OC(=O)C 660.80 unknown https://doi.org/10.1248/CPB.47.511
2-[(1S,2S,3R,7S,9S,12R,14R,17R,18R,19R,21R,22S)-2-hydroxy-3,8,8,17,19-pentamethyl-9-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracos-4-en-22-yl]propan-2-yl acetate 163080945 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CC=C6C4(C3O)C)(C)C)OC8C(C(C(CO8)O)O)O)C)O2)C(C)(C)OC(=O)C 660.80 unknown https://doi.org/10.1248/CPB.47.511
2-[[2-Hydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracos-4-en-9-yl]oxy]oxane-3,4,5-triol 75111211 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CC=C6C4(C3O)C)(C)C)OC8C(C(C(CO8)O)O)O)C)O2)C(C)(C)O 618.80 unknown https://doi.org/10.1248/CPB.47.511
2-[[2,16-Dihydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracos-4-en-9-yl]oxy]oxane-3,4,5-triol 73239319 Click to see CC1CC2C(OC3(C1C4(C(CC56CC57CCC(C(C7CC=C6C4(C3O)C)(C)C)OC8C(C(C(CO8)O)O)O)O)C)O2)C(C)(C)O 634.80 unknown https://doi.org/10.1248/CPB.49.437
2-[2-Hydroxy-3,8,8,17,19-pentamethyl-9-(3,4,5-trihydroxyoxan-2-yl)oxy-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracos-4-en-22-yl]propan-2-yl acetate 75111212 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CC=C6C4(C3O)C)(C)C)OC8C(C(C(CO8)O)O)O)C)O2)C(C)(C)OC(=O)C 660.80 unknown https://doi.org/10.1248/CPB.47.511
2'-O-Acetylactein 21592425 Click to see CC1CC2(C3C(O3)(C(O2)O)C)OC4C1C5(C(CC67CC68CCC(C(C8CCC7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)OC(=O)C)OC(=O)C)C 718.90 unknown via CMAUP database
23-epi-26-Deoxyactein 21668683 Click to see CC1CC2(C3C(O3)(CO2)C)OC4C1C5(C(CC67CC68CCC(C(C8CCC7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)OC(=O)C)C 660.80 unknown via CMAUP database
23-O-Acetyl shengmanol xyloside 13071462 Click to see CC(CC(C1C(O1)(C)C)OC(=O)C)C2C(=O)C(C3(C2(CCC45C3CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)C)C)O 662.80 unknown https://doi.org/10.1248/CPB.42.1940
23-O-acetyl-7,8-didehydroshengmanol-3-O-alpha-l-arabinopyranoside 15786366 Click to see CC(CC(C1C(O1)(C)C)OC(=O)C)C2C(=O)C(C3(C2(CCC45C3=CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)C)C)O 660.80 unknown https://doi.org/10.1248/CPB.44.2078
24-Methylene-cycloartanol 9547213 Click to see CC(C)C(=C)CCC(C)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)O)C)C 440.70 unknown https://doi.org/10.1248/CPB.47.1157
24-Methylenecycloartanol 94204 Click to see CC(C)C(=C)CCC(C)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)O)C)C 440.70 unknown https://doi.org/10.1248/CPB.47.1157
26-Deoxyactein 10974362 Click to see CC1CC2(C3C(O3)(CO2)C)OC4C1C5(C(CC67CC68CCC(C(C8CCC7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)OC(=O)C)C 660.80 unknown via CMAUP database
26-Deoxycimicifugoside 72941763 Click to see CC1CC2(C3C(O3)(CO2)C)OC4C1C5(C(CC67CC68CCC(C(C8CC=C7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)OC(=O)C)C 658.80 unknown via CMAUP database
3-[(2S,3R,4S,5R)-2-[[(1R,3R,6S,8R,12R,13R,15R,16R)-15-[(2R,4R)-4-acetyloxy-4-[(2S)-3,3-dimethyloxiran-2-yl]butan-2-yl]-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl]oxy]-4,5-dihydroxyoxan-3-yl]oxy-3-oxopropanoic acid 162962838 Click to see CC(CC(C1C(O1)(C)C)OC(=O)C)C2C(=O)C(C3(C2(CCC45C3=CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)OC(=O)CC(=O)O)C)C)O 746.90 unknown https://doi.org/10.1248/CPB.47.1175
3-[(2S,3R,4S,5R)-2-[[(1R,4R,5R,6R,8R,10R,11R,12R,16R,18S,21R)-8-[(1R)-1-acetyloxy-2-hydroxy-2-methylpropyl]-10,11-dihydroxy-4,6,12,17,17-pentamethyl-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-en-18-yl]oxy]-4,5-dihydroxyoxan-3-yl]oxy-3-oxopropanoic acid 162939495 Click to see CC1CC(OC2(C1C3(CCC45CC46CCC(C(C6CC=C5C3(C2O)C)(C)C)OC7C(C(C(CO7)O)O)OC(=O)CC(=O)O)C)O)C(C(C)(C)O)OC(=O)C 764.90 unknown https://doi.org/10.1248/CPB.47.1175
3-[(2S,3R,4S,5R)-2-[[(1S,2R,5S,7S,10R,12S,15R,16R,17S,18R,21R,22R,24S)-21,22-dihydroxy-1,6,6,15,17,20,20-heptamethyl-19,23-dioxaheptacyclo[13.10.0.02,12.05,10.010,12.016,24.018,22]pentacosan-7-yl]oxy]-4,5-dihydroxyoxan-3-yl]oxy-3-oxopropanoic acid 163008472 Click to see CC1C2C(CC3(C2(CCC45C3CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)OC(=O)CC(=O)O)C)C)OC8(C1OC(C8O)(C)C)O 706.90 unknown https://doi.org/10.1248/CPB.47.1175
3-[(2S,3R,4S,5R)-2-[[(1S,3R,6S,8R,11S,12S,13R,15R,16R)-15-[(2R,4R)-4-acetyloxy-4-[(2S)-3,3-dimethyloxiran-2-yl]butan-2-yl]-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]oxy]-4,5-dihydroxyoxan-3-yl]oxy-3-oxopropanoic acid 163041489 Click to see CC(CC(C1C(O1)(C)C)OC(=O)C)C2C(=O)C(C3(C2(CCC45C3CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)OC(=O)CC(=O)O)C)C)O 748.90 unknown https://doi.org/10.1248/CPB.47.1175
3-[2-[(21,22-Dihydroxy-1,6,6,15,17,20,20-heptamethyl-19,23-dioxaheptacyclo[13.10.0.02,12.05,10.010,12.016,24.018,22]pentacosan-7-yl)oxy]-4,5-dihydroxyoxan-3-yl]oxy-3-oxopropanoic acid 85246060 Click to see CC1C2C(CC3(C2(CCC45C3CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)OC(=O)CC(=O)O)C)C)OC8(C1OC(C8O)(C)C)O 706.90 unknown https://doi.org/10.1248/CPB.47.1175
3-[2-[[15-[4-Acetyloxy-4-(3,3-dimethyloxiran-2-yl)butan-2-yl]-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl]oxy]-4,5-dihydroxyoxan-3-yl]oxy-3-oxopropanoic acid 85254505 Click to see CC(CC(C1C(O1)(C)C)OC(=O)C)C2C(=O)C(C3(C2(CCC45C3=CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)OC(=O)CC(=O)O)C)C)O 746.90 unknown https://doi.org/10.1248/CPB.47.1175
3-[2-[[15-[4-Acetyloxy-4-(3,3-dimethyloxiran-2-yl)butan-2-yl]-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]oxy]-4,5-dihydroxyoxan-3-yl]oxy-3-oxopropanoic acid 85262765 Click to see CC(CC(C1C(O1)(C)C)OC(=O)C)C2C(=O)C(C3(C2(CCC45C3CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)OC(=O)CC(=O)O)C)C)O 748.90 unknown https://doi.org/10.1248/CPB.47.1175
3-[2-[[8-(1-Acetyloxy-2-hydroxy-2-methylpropyl)-10,11-dihydroxy-4,6,12,17,17-pentamethyl-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-en-18-yl]oxy]-4,5-dihydroxyoxan-3-yl]oxy-3-oxopropanoic acid 85211935 Click to see CC1CC(OC2(C1C3(CCC45CC46CCC(C(C6CC=C5C3(C2O)C)(C)C)OC7C(C(C(CO7)O)O)OC(=O)CC(=O)O)C)O)C(C(C)(C)O)OC(=O)C 764.90 unknown https://doi.org/10.1248/CPB.47.1175
7,7,12,16-Tetramethyl-15-(6-methylhept-5-en-2-yl)pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-en-6-ol 14137684 Click to see CC(CCC=C(C)C)C1CCC2(C1(CCC34C2=CCC5C3(C4)CCC(C5(C)C)O)C)C 424.70 unknown https://doi.org/10.1248/YAKUSHI1947.90.1_64
Actein 10032468 Click to see CC1CC2(C3C(O3)(C(O2)O)C)OC4C1C5(C(CC67CC68CCC(C(C8CCC7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)OC(=O)C)C 676.80 unknown via CMAUP database
Bugbanoside C 15894670 Click to see CC(CC(=O)C(C(C)(C)O)O)C1C(=O)C(C2(C1(C(CC34C2=CCC5C3(C4)CCC(C5(C)C)OC6C(C(C(CO6)O)O)O)OC(=O)C)C)C)O 692.80 unknown https://doi.org/10.1248/CPB.49.437
Bugbanoside D 15894671 Click to see CC(CC(=O)C1C(O1)(C)C)C2C(=O)C(C3(C2(C(CC45C3=CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)OC(=O)C)C)C)O 674.80 unknown https://doi.org/10.1248/CPB.49.437
Bugbanoside E 15894672 Click to see CC(CC(=O)C1C(O1)(C)C)C2C(=O)CC3(C2(C(CC45C3=CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)OC(=O)C)C)C 658.80 unknown https://doi.org/10.1248/CPB.49.437
Bugbanoside F 101096469 Click to see CC1CC2C(OC3(C1C4(C(CC56CC57CCC(C(C7CC=C6C4(C3O)C)(C)C)OC8C(C(C(CO8)O)O)O)O)C)O2)C(C)(C)O 634.80 unknown https://doi.org/10.1248/CPB.49.437
CID 101577840 101577840 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CC=C6C4(C3O)C)(C)C)O)C)O2)C(C)(C)O 486.70 unknown via CMAUP database
CID 128327 128327 Click to see CC1CC2(C3C(O3)(C(O2)O)C)OC4C1C5(C(CC67CC68CCC(C(C8CC=C7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)OC(=O)C)C 674.80 unknown via CMAUP database
CID 20054872 20054872 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)O)C)O2)C(C)(C)O 488.70 unknown via CMAUP database
CID 21594792 21594792 Click to see CC1CC2(C3C(O3)(C(O2)O)C)OC4C1C5(C(CC67CC68CCC(C(C8CCC7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)OC(=O)C)C 676.80 unknown via CMAUP database
CID 24721455 24721455 Click to see CC1CC2(C3C(O3)(C(O2)O)C)OC4C1C5(C(CC67CC68CCC(C(C8CC=C7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)OC(=O)C)C 674.80 unknown via CMAUP database
CID 24764419 24764419 Click to see CC1CC2(C3C(O3)(C(O2)O)C)OC4C1C5(C(CC67CC68CCC(C(C8CCC7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)OC(=O)C)C 676.80 unknown via CMAUP database
CID 441913 441913 Click to see CC1CC2(C3C(O3)(C(O2)O)C)OC4C1C5(C(CC67CC68CCC(C(C8CC=C7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)OC(=O)C)C 674.80 unknown via CMAUP database
CID 71448947 71448947 Click to see CC1CC(OC2C1C3(CCC45CC46CCC(C(C6CCC5C3(C2=O)C)(C)C)O)C)C(C(C)(C)O)O 488.70 unknown via CMAUP database
Cimiaceroside B 398801 Click to see CC1C2C(CC3(C2(CCC45C3CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)C)C)OC8(C1OC(C8O)(C)C)O 620.80 unknown via CMAUP database
Cimicidanol 10413064 Click to see CC(CC(=O)C1C(O1)(C)C)C2C(=O)CC3(C2(CC(C45C3=CCC6C4(C5)CCC(C6(C)C)O)O)C)C 484.70 unknown via CMAUP database
Cimicidanol 3-arabinoside 45934454 Click to see CC(CC(=O)C1C(O1)(C)C)C2C(=O)CC3(C2(CC(C45C3=CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)O)C)C 616.80 unknown https://doi.org/10.1248/CPB.42.2205
Cimicifugenol 44423584 Click to see CC(CCC=C(C)C)C1=CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)O)C)C 424.70 unknown https://doi.org/10.1248/CPB.47.1157
Cimicifugoside 399179 Click to see CC1CC2(C3C(O3)(C(O2)O)C)OC4C1C5(C(CC67CC68CCC(C(C8CC=C7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)OC(=O)C)C 674.80 unknown via CMAUP database
Cimicifugoside H-2 10100589 Click to see CC(CC(=O)C(C(C)(C)O)O)C1C(=O)CC2(C1(CC(C34C2=CCC5C3(C4)CCC(C5(C)C)OC6C(C(C(CO6)O)O)O)O)C)C 634.80 unknown https://doi.org/10.1248/CPB.43.771
Cimicifugoside H1 15241163 Click to see CC(CC(=O)C1C(O1)(C)C)C2C(=O)CC3(C2(CC(C45C3=CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)O)C)C 616.80 unknown https://doi.org/10.1248/CPB.42.2205
https://doi.org/10.1248/CPB.43.771
Cimigenol 16020000 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)O)C)O2)C(C)(C)O 488.70 unknown via CMAUP database
Cimigol 6453550 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)O)C)O2)C(C)(C)O 488.70 unknown via CMAUP database
Cimiracemoside I 21591917 Click to see CC1CC2(C3C(O3)(CO2)C)OC4C1C5(CCC67CC68CCC(C(C8CC=C7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)C 600.80 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 https://doi.org/10.1248/CPB.47.1157
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Ergostane steroids / Ergosterols and derivatives
Fungisterol 5283646 Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2=CCC4C3(CCC(C4)O)C)C 400.70 unknown via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Hydroxysteroids
(2S,3R,4S,5R)-2-[[(1R,9S,12R,14S,17R,22S)-2-hydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17-tetramethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]oxane-3,4,5-triol 6324926 Click to see CC1(C2CCC3C4(C(C56C(C4(CCC37C2(C7)CCC1OC8C(C(C(CO8)O)O)O)C)CCC(O5)C(O6)C(C)(C)O)O)C)C 606.80 unknown via CMAUP database
2-[(9S,12R,14R,17R,22S)-2-hydroxy-3,8,8,17-tetramethyl-9-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracos-4-en-22-yl]propan-2-yl acetate 6324872 Click to see CC(=O)OC(C)(C)C1C2CCC3C4(CCC56CC57CCC(C(C7CC=C6C4(C(C3(O2)O1)O)C)(C)C)OC8C(C(C(CO8)O)O)O)C 646.80 unknown via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal glycosides
18-Hydroxy-15-(5-hydroxy-4-oxopentan-2-yl)-7,7,12,16-tetramethyl-6-(3,4,5-trihydroxyoxan-2-yl)oxypentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-en-14-one 163047785 Click to see CC(CC(=O)CO)C1C(=O)CC2(C1(CC(C34C2=CCC5C3(C4)CCC(C5(C)C)OC6C(C(C(CO6)O)O)O)O)C)C 576.70 unknown https://doi.org/10.1248/CPB.42.2205
2,9,10-Trihydroxy-4,6,12,17,17-pentamethyl-18-(3,4,5-trihydroxyoxan-2-yl)oxyhexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-en-8-one 85090709 Click to see CC1CC(=O)C(C2(C1C3(CC(C45CC46CCC(C(C6CC=C5C3(C2)C)(C)C)OC7C(C(C(CO7)O)O)O)O)C)O)O 576.70 unknown https://doi.org/10.1248/CPB.42.2205
Cimicifugoside H-3 15241164 Click to see CC(CC(=O)CO)C1C(=O)CC2(C1(CC(C34C2=CCC5C3(C4)CCC(C5(C)C)OC6C(C(C(CO6)O)O)O)O)C)C 576.70 unknown https://doi.org/10.1248/CPB.42.2205
Cimicifugoside H-4 10008346 Click to see CC1CC(=O)C(C2(C1C3(CC(C45CC46CCC(C(C6CC=C5C3(C2)C)(C)C)OC7C(C(C(CO7)O)O)O)O)C)O)O 576.70 unknown https://doi.org/10.1248/CPB.42.2205
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal glycosides / Steroidal saponins / Cucurbitacin glycosides
(2R,3R,4S,5R,6R)-2-[[(1S,2R,3S,4R,7R,9S,12R,14S,17R,18R,19R,21R,22S)-2-hydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol 102600398 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(C(O8)CO)O)O)O)C)O2)C(C)(C)O 650.80 unknown https://doi.org/10.1248/CPB.44.2078
https://doi.org/10.1248/CPB.47.511
(2R,3R,4S,5R,6R)-2-[[(1S,2R,3S,4R,7R,9S,12R,14S,17R,18R,19R,21R,22S)-2-hydroxy-22-(2-methoxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol 102600399 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(C(O8)CO)O)O)O)C)O2)C(C)(C)OC 664.90 unknown https://doi.org/10.1248/CPB.44.2078
(2R,3R,4S,5R,6R)-2-[[(1S,2R,3S,4S,7S,9S,11S,12S,14S,17R,18R,19R,21R,22S)-2,11-dihydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol 162901820 Click to see CC1CC2C(OC3(C1C4(CCC56CC57C(CCC6C4(C3O)C)C(C(CC7O)OC8C(C(C(C(O8)CO)O)O)O)(C)C)C)O2)C(C)(C)O 666.80 unknown https://doi.org/10.1248/CPB.47.511
(2R,3R,4S,5S)-2-[[(1S,2R,3S,9S,17R,19R,22R)-2-hydroxy-22-(2-methoxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]oxane-3,4,5-triol 11856241 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(CO8)O)O)O)C)O2)C(C)(C)OC 634.80 unknown via CMAUP database
(2S,3R,4S,5S)-2-[[(1S,2S,3S,4S,7S,9S,11S,12S,14S,17R,18R,19R,21R,22S)-2,11-dihydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]oxane-3,4,5-triol 162897218 Click to see CC1CC2C(OC3(C1C4(CCC56CC57C(CCC6C4(C3O)C)C(C(CC7O)OC8C(C(C(CO8)O)O)O)(C)C)C)O2)C(C)(C)O 636.80 unknown https://doi.org/10.1248/CPB.47.511
[(1R)-1-[(1S,4R,5R,6R,8R,10R,11R,12S,13R,16R,18S,21R)-10,11-dihydroxy-4,6,12,17,17-pentamethyl-18-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-8-yl]-2-hydroxy-2-methylpropyl] acetate 102600396 Click to see CC1CC(OC2(C1C3(CCC45CC46CCC(C(C6CCC5C3(C2O)C)(C)C)OC7C(C(C(C(O7)CO)O)O)O)C)O)C(C(C)(C)O)OC(=O)C 710.90 unknown https://doi.org/10.1248/CPB.44.2078
https://doi.org/10.1248/CPB.47.511
[(1R)-2-hydroxy-2-methyl-1-[(1S,4R,5R,6R,8R,10R,11R,12S,13R,14S,16R,18S,21R)-10,11,14-trihydroxy-4,6,12,17,17-pentamethyl-18-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-8-yl]propyl] acetate 163005216 Click to see CC1CC(OC2(C1C3(CCC45CC46CCC(C(C6CC(C5C3(C2O)C)O)(C)C)OC7C(C(C(CO7)O)O)O)C)O)C(C(C)(C)O)OC(=O)C 696.90 unknown https://doi.org/10.1248/CPB.44.2078
[(1S)-1-[(1S,4R,5R,6R,8R,10R,11R,12S,13R,16R,18S,21R)-10,11-dihydroxy-4,6,12,17,17-pentamethyl-18-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-8-yl]-2-methoxy-2-methylpropyl] acetate 162915170 Click to see CC1CC(OC2(C1C3(CCC45CC46CCC(C(C6CCC5C3(C2O)C)(C)C)OC7C(C(C(CO7)O)O)O)C)O)C(C(C)(C)OC)OC(=O)C 694.90 unknown https://doi.org/10.1248/CPB.44.2078
[(1S)-2-methoxy-2-methyl-1-[(1S,4R,5R,6R,8R,10R,11R,12S,13R,14S,16R,18S,21R)-10,11,14-trihydroxy-4,6,12,17,17-pentamethyl-18-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-8-yl]propyl] acetate 162961032 Click to see CC1CC(OC2(C1C3(CCC45CC46CCC(C(C6CC(C5C3(C2O)C)O)(C)C)OC7C(C(C(CO7)O)O)O)C)O)C(C(C)(C)OC)OC(=O)C 710.90 unknown https://doi.org/10.1248/CPB.44.2078
[(1S)-2-methoxy-2-methyl-1-[(1S,4R,5R,6R,8R,10S,11R,12S,13R,16S,18S,20S,21S)-10,11,20-trihydroxy-4,6,12,17,17-pentamethyl-18-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-8-yl]propyl] acetate 162942837 Click to see CC1CC(OC2(C1C3(CCC45CC46C(CCC5C3(C2O)C)C(C(CC6O)OC7C(C(C(CO7)O)O)O)(C)C)C)O)C(C(C)(C)OC)OC(=O)C 710.90 unknown https://doi.org/10.1248/CPB.44.2078
[1-[10,11-Dihydroxy-4,6,12,17,17-pentamethyl-18-(3,4,5-trihydroxyoxan-2-yl)oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-8-yl]-2-methoxy-2-methylpropyl] acetate 85286528 Click to see CC1CC(OC2(C1C3(CCC45CC46CCC(C(C6CCC5C3(C2O)C)(C)C)OC7C(C(C(CO7)O)O)O)C)O)C(C(C)(C)OC)OC(=O)C 694.90 unknown https://doi.org/10.1248/CPB.44.2078
[1-[10,11-Dihydroxy-4,6,12,17,17-pentamethyl-18-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-8-yl]-2-hydroxy-2-methylpropyl] acetate 85229121 Click to see CC1CC(OC2(C1C3(CCC45CC46CCC(C(C6CCC5C3(C2O)C)(C)C)OC7C(C(C(C(O7)CO)O)O)O)C)O)C(C(C)(C)O)OC(=O)C 710.90 unknown https://doi.org/10.1248/CPB.44.2078
https://doi.org/10.1248/CPB.47.511
[2-Hydroxy-2-methyl-1-[10,11,14-trihydroxy-4,6,12,17,17-pentamethyl-18-(3,4,5-trihydroxyoxan-2-yl)oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-8-yl]propyl] acetate 85286542 Click to see CC1CC(OC2(C1C3(CCC45CC46CCC(C(C6CC(C5C3(C2O)C)O)(C)C)OC7C(C(C(CO7)O)O)O)C)O)C(C(C)(C)O)OC(=O)C 696.90 unknown https://doi.org/10.1248/CPB.44.2078
[2-Methoxy-2-methyl-1-[10,11,14-trihydroxy-4,6,12,17,17-pentamethyl-18-(3,4,5-trihydroxyoxan-2-yl)oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-8-yl]propyl] acetate 85165546 Click to see CC1CC(OC2(C1C3(CCC45CC46CCC(C(C6CC(C5C3(C2O)C)O)(C)C)OC7C(C(C(CO7)O)O)O)C)O)C(C(C)(C)OC)OC(=O)C 710.90 unknown https://doi.org/10.1248/CPB.44.2078
[2-Methoxy-2-methyl-1-[10,11,20-trihydroxy-4,6,12,17,17-pentamethyl-18-(3,4,5-trihydroxyoxan-2-yl)oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-8-yl]propyl] acetate 85286595 Click to see CC1CC(OC2(C1C3(CCC45CC46C(CCC5C3(C2O)C)C(C(CC6O)OC7C(C(C(CO7)O)O)O)(C)C)C)O)C(C(C)(C)OC)OC(=O)C 710.90 unknown https://doi.org/10.1248/CPB.44.2078
2-[(1S,2R,3S,4R,7R,9S,12R,14S,17R,18R,19R,21R,22S)-2-hydroxy-3,8,8,17,19-pentamethyl-9-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-22-yl]propan-2-yl acetate 102600400 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(C(O8)CO)O)O)O)C)O2)C(C)(C)OC(=O)C 692.90 unknown https://doi.org/10.1248/CPB.44.2078
2-[(1S,2R,3S,4R,7R,9S,12R,14S,17R,18R,19R,21R,22S)-2-hydroxy-3,8,8,17,19-pentamethyl-9-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-22-yl]propan-2-yl acetate 15786373 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(C(O8)CO)O)O)O)C)O2)C(C)(C)OC(=O)C 692.90 unknown https://doi.org/10.1248/CPB.44.2078
2-[(1S,2R,3S,4R,7R,9S,12R,14S,17R,18R,19R,21R,22S)-9-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-hydroxy-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-22-yl]propan-2-yl acetate 163037093 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(CO8)O)OC9C(C(C(C(O9)CO)O)O)O)O)C)O2)C(C)(C)OC(=O)C 825.00 unknown https://doi.org/10.1248/CPB.42.1940
2-[(1S,2R,3S,4R,7S,9S,11S,12S,14S,17R,18R,19R,21R,22S)-2,11-dihydroxy-3,8,8,17,19-pentamethyl-9-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-22-yl]propan-2-yl acetate 15225907 Click to see CC1CC2C(OC3(C1C4(CCC56CC57C(CCC6C4(C3O)C)C(C(CC7O)OC8C(C(C(CO8)O)O)O)(C)C)C)O2)C(C)(C)OC(=O)C 678.80 unknown https://doi.org/10.1248/CPB.43.279
2-[[2-Hydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol 73156999 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(C(O8)CO)O)O)O)C)O2)C(C)(C)O 650.80 unknown https://doi.org/10.1248/CPB.44.2078
https://doi.org/10.1248/CPB.47.511
2-[[2-Hydroxy-22-(2-methoxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol 85184227 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(C(O8)CO)O)O)O)C)O2)C(C)(C)OC 664.90 unknown https://doi.org/10.1248/CPB.44.2078
2-[[2,11-Dihydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol 85193499 Click to see CC1CC2C(OC3(C1C4(CCC56CC57C(CCC6C4(C3O)C)C(C(CC7O)OC8C(C(C(C(O8)CO)O)O)O)(C)C)C)O2)C(C)(C)O 666.80 unknown https://doi.org/10.1248/CPB.47.511
2-[[2,11-Dihydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]oxane-3,4,5-triol 73091670 Click to see CC1CC2C(OC3(C1C4(CCC56CC57C(CCC6C4(C3O)C)C(C(CC7O)OC8C(C(C(CO8)O)O)O)(C)C)C)O2)C(C)(C)O 636.80 unknown https://doi.org/10.1248/CPB.47.511
2-[2-Hydroxy-3,8,8,17,19-pentamethyl-9-(3,4,5-trihydroxyoxan-2-yl)oxy-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-22-yl]propan-2-yl acetate 72799835 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(CO8)O)O)O)C)O2)C(C)(C)OC(=O)C 662.80 unknown https://doi.org/10.1248/CPB.42.1940
2-[2-Hydroxy-3,8,8,17,19-pentamethyl-9-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-22-yl]propan-2-yl acetate 85175060 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(C(O8)CO)O)O)O)C)O2)C(C)(C)OC(=O)C 692.90 unknown https://doi.org/10.1248/CPB.44.2078
2-[2,11-Dihydroxy-3,8,8,17,19-pentamethyl-9-(3,4,5-trihydroxyoxan-2-yl)oxy-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-22-yl]propan-2-yl acetate 162936777 Click to see CC1CC2C(OC3(C1C4(CCC56CC57C(CCC6C4(C3O)C)C(C(CC7O)OC8C(C(C(CO8)O)O)O)(C)C)C)O2)C(C)(C)OC(=O)C 678.80 unknown https://doi.org/10.1248/CPB.43.279
2-[9-[3,5-Dihydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-hydroxy-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-22-yl]propan-2-yl acetate 163037092 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(CO8)O)OC9C(C(C(C(O9)CO)O)O)O)O)C)O2)C(C)(C)OC(=O)C 825.00 unknown https://doi.org/10.1248/CPB.42.1940
25-O-Acetylcimigenol xyloside 91826996 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(CO8)O)O)O)C)O2)C(C)(C)OC(=O)C 662.80 unknown https://doi.org/10.1248/CPB.42.1940
Cimigenol xyloside 16088242 Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(CO8)O)O)O)C)O2)C(C)(C)O 620.80 unknown https://doi.org/10.1248/YAKUSHI1947.103.3_293
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / N-acyl-alpha amino acids / N-acyl-L-alpha-amino acids
Acetylcysteine 12035 Click to see CC(=O)NC(CS)C(=O)O 163.20 unknown https://doi.org/10.1248/CPB.46.467
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Aryl-aldehydes
5-Methylfurfural 12097 Click to see CC1=CC=C(O1)C=O 110.11 unknown via CMAUP database
Furfural 7362 Click to see C1=COC(=C1)C=O 96.08 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Medium-chain aldehydes
2,4-Decadienal 5283349 Click to see CCCCCC=CC=CC=O 152.23 unknown via CMAUP database
Decanal 8175 Click to see CCCCCCCCCC=O 156.26 unknown via CMAUP database
Dodecanal 8194 Click to see CCCCCCCCCCCC=O 184.32 unknown via CMAUP database
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
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Alpha,beta-unsaturated ketones / Enones
(3Z)-6-methylhepta-3,5-dien-2-one 12510894 Click to see CC(=CC=CC(=O)C)C 124.18 unknown via CMAUP database
6-Methyl-3,5-heptadien-2-one 5370101 Click to see CC(=CC=CC(=O)C)C 124.18 unknown via CMAUP database
Damascenone 5366074 Click to see CC=CC(=O)C1=C(C=CCC1(C)C)C 190.28 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aryl ketones / Aryl alkyl ketones
2-Acetylpyrrole 14079 Click to see CC(=O)C1=CC=CN1 109.13 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Cyclic ketones
2-(Hex-3-enyl)cyclopentan-1-one 6437472 Click to see CCC=CCCC1CCCC1=O 166.26 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones
6-Methyl-5-hepten-2-one 9862 Click to see CC(=CCCC(=O)C)C 126.20 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Phenylketones / Alkyl-phenylketones
1-(3,5-Dihydroxyphenyl)nonan-1-one 49778007 Click to see CCCCCCCCC(=O)C1=CC(=CC(=C1)O)O 250.33 unknown https://doi.org/10.1248/CPB.46.362
3'-Methoxyacetophenone 11460 Click to see CC(=O)C1=CC(=CC=C1)OC 150.17 unknown via CMAUP database
Paeonol 11092 Click to see CC(=O)C1=C(C=C(C=C1)OC)O 166.17 unknown https://doi.org/10.1080/14786410500182037
Resacetophenone 6990 Click to see CC(=O)C1=C(C=C(C=C1)O)O 152.15 unknown via CMAUP database
> Organoheterocyclic compounds / Benzofurans / Dibenzofurans
Dibenzofuran 568 Click to see C1=CC=C2C(=C1)C3=CC=CC=C3O2 168.19 unknown via CMAUP database
> Organoheterocyclic compounds / Benzopyrans / 1-benzopyrans / Chromones / Furanochromones
Ammiol 621572 Click to see COC1=C2C(=O)C=C(OC2=C(C3=C1C=CO3)OC)CO 276.24 unknown via CMAUP database
Cimifugin 441960 Click to see CC(C)(C1CC2=C(O1)C=C3C(=C2OC)C(=O)C=C(O3)CO)O 306.31 unknown via CMAUP database
Khellol 164613 Click to see COC1=C2C=COC2=CC3=C1C(=O)C=C(O3)CO 246.21 unknown via CMAUP database
> Organoheterocyclic compounds / Heteroaromatic compounds
2-Pentylfuran 19602 Click to see CCCCCC1=CC=CO1 138.21 unknown via CMAUP database
> Organoheterocyclic compounds / Indoles and derivatives / Carbazoles
2-Methyl-7-hydroxycarbazole 68547224 Click to see CC1=CC2=C(C=C1)C3=C(N2)C=C(C=C3)O 197.23 unknown https://doi.org/10.3987/COM-93-6472
> Organoheterocyclic compounds / Indoles and derivatives / Indoles
Indole 798 Click to see C1=CC=C2C(=C1)C=CN2 117.15 unknown via CMAUP database
> Organoheterocyclic compounds / Isobenzofurans
(E)-3-Butylidene-4,5-dihydroisobenzofuran-1(3H)-one 5877292 Click to see CCCC=C1C2=C(C=CCC2)C(=O)O1 190.24 unknown via CMAUP database
Ligustilide 5319022 Click to see CCCC=C1C2=C(C=CCC2)C(=O)O1 190.24 unknown via CMAUP database
> Organoheterocyclic compounds / Lactones / Delta valerolactones
[(1S,4aR,7S,8S,8aS)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-7-methyl-1,2,3,4,4a,7,8,8a-octahydronaphthalen-1-yl] (2S)-2-methylbutanoate 11303936 Click to see CCC(C)C(=O)OC1CCCC2C1C(C(C=C2)C)CCC3CC(CC(=O)O3)O 392.50 unknown https://doi.org/10.1248/CPB.44.2078
https://doi.org/10.1248/CPB.47.511
> Organoheterocyclic compounds / Lactones / Gamma butyrolactones
Gamma-nonalactone 7710 Click to see CCCCCC1CCC(=O)O1 156.22 unknown via CMAUP database
> Organoheterocyclic compounds / Tetrahydrofurans
Linalyl oxide 22310 Click to see CC1(CCC(O1)C(C)(C)O)C=C 170.25 unknown via CMAUP database
> Organosulfur compounds
(4s,6r,z)-4-Methylundeca-1,9-diene-6-sulfonothioic acid 21776380 Click to see CC=CCCC(CC(C)CC=C)S(=O)(=S)O 262.40 unknown https://doi.org/10.1248/CPB.44.2078
https://doi.org/10.1248/CPB.47.511
> Phenylpropanoids and polyketides / Cinnamaldehydes
Cinnamaldehyde 637511 Click to see C1=CC=C(C=C1)C=CC=O 132.16 unknown via CMAUP database
cis-Cinnamaldehyde 6428995 Click to see C1=CC=C(C=C1)C=CC=O 132.16 unknown https://doi.org/10.1080/14786410500182037
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives
(2R,3S)-2-[(3,4-dihydroxyphenyl)methyl]-3-[3-(3,4-dimethoxyphenyl)prop-2-enoyloxy]-2-hydroxybutanedioic acid 162900529 Click to see COC1=C(C=C(C=C1)C=CC(=O)OC(C(=O)O)C(CC2=CC(=C(C=C2)O)O)(C(=O)O)O)OC 462.40 unknown https://doi.org/10.1021/NP900752T
(2S,3R)-2-Hydroxy-3-(3-methoxy-4-hydroxycinnamoyloxy)-2-[(3,4-dihydroxyphenyl)methyl]butanedioic acid 100913813 Click to see COC1=C(C=CC(=C1)C=CC(=O)OC(C(=O)O)C(CC2=CC(=C(C=C2)O)O)(C(=O)O)O)O 448.40 unknown via CMAUP database
(4R)-3-[(3,4-dihydroxyphenyl)methyl]-4-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-3-hydroxyhexanedioic acid 5317411 Click to see C1=CC(=C(C=C1CC(CC(=O)O)(C(CC(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O)O 462.40 unknown https://doi.org/10.1248/CPB.46.362
2-[(3,4-Dihydroxyphenyl)methyl]-2-hydroxy-3-[3-(3-hydroxy-4-methoxyphenyl)prop-2-enoyloxy]butanedioic acid 78410703 Click to see COC1=C(C=C(C=C1)C=CC(=O)OC(C(=O)O)C(CC2=CC(=C(C=C2)O)O)(C(=O)O)O)O 448.40 unknown https://doi.org/10.1248/CPB.46.362
2-[(3,4-Dihydroxyphenyl)methyl]-2-hydroxy-3-[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyloxy]butanedioic acid 78410702 Click to see COC1=C(C=CC(=C1)C=CC(=O)OC(C(=O)O)C(CC2=CC(=C(C=C2)O)O)(C(=O)O)O)O 448.40 unknown https://doi.org/10.1248/CPB.46.362
2-[(3,4-Dihydroxyphenyl)methyl]-3-[3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]-2-hydroxybutanedioic acid 76046285 Click to see C1=CC(=C(C=C1CC(C(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)(C(=O)O)O)O)O 434.30 unknown https://doi.org/10.1248/CPB.46.362
2-[(3,4-Dihydroxyphenyl)methyl]-3-[3-(3,4-dimethoxyphenyl)prop-2-enoyloxy]-2-hydroxybutanedioic acid 73043779 Click to see COC1=C(C=C(C=C1)C=CC(=O)OC(C(=O)O)C(CC2=CC(=C(C=C2)O)O)(C(=O)O)O)OC 462.40 unknown https://doi.org/10.1021/NP900752T
2-Hydroxy-3-[3-(3-hydroxy-4-methoxyphenyl)prop-2-enoyloxy]-2-[(4-hydroxyphenyl)methyl]butanedioic acid 78410759 Click to see COC1=C(C=C(C=C1)C=CC(=O)OC(C(=O)O)C(CC2=CC=C(C=C2)O)(C(=O)O)O)O 432.40 unknown https://doi.org/10.1016/S0031-9422(98)00407-5
2-Hydroxy-3-[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyloxy]-2-[(4-hydroxyphenyl)methyl]butanedioic acid 85088918 Click to see COC1=C(C=CC(=C1)C=CC(=O)OC(C(=O)O)C(CC2=CC=C(C=C2)O)(C(=O)O)O)O 432.40 unknown https://doi.org/10.1016/S0031-9422(98)00407-5
3-[3-(3,4-Dihydroxyphenyl)prop-2-enoyloxy]-2-hydroxy-2-[(4-hydroxyphenyl)methyl]butanedioic acid 73082224 Click to see C1=CC(=CC=C1CC(C(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)(C(=O)O)O)O 418.30 unknown https://doi.org/10.1016/S0031-9422(98)00407-5
3,4-Dimethoxycinnamic acid 717531 Click to see COC1=C(C=C(C=C1)C=CC(=O)O)OC 208.21 unknown https://doi.org/10.1248/CPB.46.362
Caffeic acid methyl ester 689075 Click to see COC(=O)C=CC1=CC(=C(C=C1)O)O 194.18 unknown via CMAUP database
Cimicifugic acid A 6449879 Click to see COC1=C(C=CC(=C1)C=CC(=O)OC(C(=O)O)C(CC2=CC(=C(C=C2)O)O)(C(=O)O)O)O 448.40 unknown https://doi.org/10.1248/CPB.46.362
Cimicifugic acid B 6449880 Click to see COC1=C(C=C(C=C1)C=CC(=O)OC(C(=O)O)C(CC2=CC(=C(C=C2)O)O)(C(=O)O)O)O 448.40 unknown https://doi.org/10.1248/CPB.46.362
Cimicifugic acid D 11742743 Click to see C1=CC(=CC=C1CC(C(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)(C(=O)O)O)O 418.30 unknown https://doi.org/10.1016/S0031-9422(98)00407-5
Cimicifugic acid E 10002902 Click to see COC1=C(C=CC(=C1)C=CC(=O)OC(C(=O)O)C(CC2=CC=C(C=C2)O)(C(=O)O)O)O 432.40 unknown https://doi.org/10.1016/S0031-9422(98)00407-5
Cimicifugic acid F 6450179 Click to see COC1=C(C=C(C=C1)C=CC(=O)OC(C(=O)O)C(CC2=CC=C(C=C2)O)(C(=O)O)O)O 432.40 unknown https://doi.org/10.1016/S0031-9422(98)00407-5
Cimicifugic acid L 46210732 Click to see COC1=C(C=C(C=C1)C=CC(=O)OC(C(=O)O)C(CC2=CC=C(C=C2)O)(C(=O)O)O)OC 446.40 unknown https://doi.org/10.1021/NP900752T
Cimicifugic acid M 46210733 Click to see C1=CC=C(C=C1)CC(C(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)(C(=O)O)O 402.40 unknown https://doi.org/10.1021/NP900752T
Cimicifugic acid N 46210734 Click to see COC1=C(C=C(C=C1)C=CC(=O)OC(C(=O)O)C(CC2=CC(=C(C=C2)O)O)(C(=O)O)O)OC 462.40 unknown https://doi.org/10.1021/NP900752T
Cimiracemate A 5315874 Click to see COC1=C(C=C(C=C1)C=CC(=O)OCC(=O)CC2=CC(=C(C=C2)O)O)O 358.30 unknown via CMAUP database
Cimiracemate B 5315876 Click to see COC1=C(C=CC(=C1)C=CC(=O)OCC(=O)CC2=CC(=C(C=C2)O)O)O 358.30 unknown via CMAUP database
Cimiracemate C 5315877 Click to see COC1=C(C=C(C=C1)C=CC(=O)OCC(=O)C(C2=CC(=C(C=C2)O)O)OC)O 388.40 unknown via CMAUP database
Cimiracemate D 5315878 Click to see COC1=C(C=CC(=C1)C=CC(=O)OCC(=O)C(C2=CC(=C(C=C2)O)O)OC)O 388.40 unknown via CMAUP database
Fukinolic acid 6441059 Click to see C1=CC(=C(C=C1CC(C(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)(C(=O)O)O)O)O 434.30 unknown https://doi.org/10.1248/CPB.46.362
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acid esters / Coumaric acid esters
2-[(3,4-Dihydroxyphenyl)methyl]-2-hydroxy-3-[3-(4-hydroxyphenyl)prop-2-enoyloxy]butanedioic acid 76046101 Click to see C1=CC(=CC=C1C=CC(=O)OC(C(=O)O)C(CC2=CC(=C(C=C2)O)O)(C(=O)O)O)O 418.30 unknown https://doi.org/10.1248/CPB.46.362
Cimicifugic acid C 6450178 Click to see C1=CC(=CC=C1C=CC(=O)OC(C(=O)O)C(CC2=CC(=C(C=C2)O)O)(C(=O)O)O)O 418.30 unknown https://doi.org/10.1016/S0031-9422(00)80460-4
https://doi.org/10.1248/CPB.46.362
Cimicifugic acid K 46210731 Click to see C1=CC(=CC=C1CC(C(C(=O)O)OC(=O)C=CC2=CC=C(C=C2)O)(C(=O)O)O)O 402.40 unknown https://doi.org/10.1021/NP900752T
> 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/10.1248/CPB.46.362
https://doi.org/10.1021/NP900752T
3-(3-Hydroxy-4-methoxy-phenyl)-acrylic acid 92126 Click to see COC1=C(C=C(C=C1)C=CC(=O)O)O 194.18 unknown https://doi.org/10.1021/NP900752T
https://doi.org/10.1248/CPB.46.362
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/10.1248/CPB.46.362
4-Hydroxycinnamic acid 322 Click to see C1=CC(=CC=C1C=CC(=O)O)O 164.16 unknown https://doi.org/10.1248/CPB.46.362
Caffeic Acid 689043 Click to see C1=CC(=C(C=C1C=CC(=O)O)O)O 180.16 unknown https://doi.org/10.1248/CPB.46.362
cis-Caffeic acid 1549111 Click to see C1=CC(=C(C=C1C=CC(=O)O)O)O 180.16 unknown via CMAUP database
cis-Sinapic acid 1549091 Click to see COC1=CC(=CC(=C1O)OC)C=CC(=O)O 224.21 unknown via CMAUP database
Ferulic acid 445858 Click to see COC1=C(C=CC(=C1)C=CC(=O)O)O 194.18 unknown https://doi.org/10.1248/CPB.46.362
Isoferulic acid 736186 Click to see COC1=C(C=C(C=C1)C=CC(=O)O)O 194.18 unknown https://doi.org/10.1021/NP900752T
https://doi.org/10.1248/CPB.46.362
p-Coumaric acid 637542 Click to see C1=CC(=CC=C1C=CC(=O)O)O 164.16 unknown https://doi.org/10.1248/CPB.46.362
Sinapinic acid 637775 Click to see COC1=CC(=CC(=C1O)OC)C=CC(=O)O 224.21 unknown via CMAUP database
> Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins / 6,7-dihydroxycoumarins
Esculetin 5281416 Click to see C1=CC(=O)OC2=CC(=C(C=C21)O)O 178.14 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Flavanones
7-Hydroxy-8-(3-hydroxy-3-methylbut-1-enyl)-2-phenyl-2,3-dihydrochromen-4-one 74323707 Click to see CC(C)(C=CC1=C(C=CC2=C1OC(CC2=O)C3=CC=CC=C3)O)O 324.40 unknown https://doi.org/10.1248/CPB.46.362
> Phenylpropanoids and polyketides / Phenylpropanoic acids
(2S,3R)-2,3-dihydroxy-2-[(4-hydroxyphenyl)methyl]butanedioic acid 6710641 Click to see C1=CC(=CC=C1CC(C(C(=O)O)O)(C(=O)O)O)O 256.21 unknown via CMAUP database
Butanedioic acid, 2,3-dihydroxy-2-((4-hydroxyphenyl)methyl)-, (2R,3S)- 10038020 Click to see C1=CC(=CC=C1CC(C(C(=O)O)O)(C(=O)O)O)O 256.21 unknown https://doi.org/10.1016/S0031-9422(00)80460-4
https://doi.org/10.1016/S0031-9422(98)00407-5
Fukiic acid 161871 Click to see C1=CC(=C(C=C1CC(C(C(=O)O)O)(C(=O)O)O)O)O 272.21 unknown https://doi.org/10.1248/CPB.46.362
Piscidic acid 120693 Click to see C1=CC(=CC=C1CC(C(C(=O)O)O)(C(=O)O)O)O 256.21 unknown https://doi.org/10.1016/S0031-9422(98)00407-5
> Phenylpropanoids and polyketides / Stilbenes
Phenol, (Z)- 5469252 Click to see COC1=CC=CC(=C1)C=CC2=CC=C(C=C2)O 226.27 unknown via CMAUP database

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