CHOLEST-7-EN-3-BETA-OL ACETATE

Structure

2D structure of CHOLEST-7-EN-3-BETA-OL ACETATE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 14056045

Names and identifiers

Name

CHOLEST-7-EN-3-BETA-OL ACETATE

IUPAC name

(3S,5S,9R,10S,13R,14R,17R)-10,13-dimethyl-17-((R)-6-methylheptan-2-yl)-2,3,4,5,6,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl acetate

SMILES

C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CC[C@@H]4[C@@]3(CC[C@@H](C4)OC(C)=O)C)C

General information

Molecular formula

C29H48O2

Molecular weight

428.70 g/mol

Monoisotopic mass

428.3654 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

Chemical classification: NPClassifier (Kim et al., 2021)

Plants with the compound

Plant Plant part Amount Reference
Bryonia dioica Jacq. aerial parts -
Akihisa, T., Kimura, Y., Koike, K., Kokke, W.C.M.C., Nikaido, T., Tamura, T. (1998). Cycloartane triterpenoids from the aerial part of Bryonia dioica. Phytochemistry, 49(6), 1757-1760 doi:10.1016/s0031-9422(98)00287-8