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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP028627

25-Acetoxy-ergosta-3beta,5alpha,6beta-triol

Formula: C30H52O5  |  Mol. Weight: 492.70 g/mol

IUPAC: [(3S,6R)-2,3-dimethyl-6-[(3S,5R,6R,8S,9S,10R,13R,14S,17R)-3,5,6-trihydroxy-10,13-dimethyl-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]heptan-2-yl] acetate

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Overview

Molecular Formula C30H52O5
Molecular Weight 492.70 g/mol
Canonical SMILES CC(CCC(C)C(C)(C)OC(=O)C)C1CCC2C1(CCC3C2CC(C4(C3(CCC(C4)O)C)O)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy