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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP030288

[(1S)-1-[(3S,8S,9R,10R,12R,13R,14R,17S)-3,8,12,14,17-pentahydroxy-10,13-dimethyl-1,2,3,4,7,9,11,12,15,16-decahydrocyclopenta[a]phenanthren-17-yl]ethyl] (E)-3-phenylprop-2-enoate

Formula: C30H40O7  |  Mol. Weight: 512.60 g/mol

IUPAC: [(1S)-1-[(3S,8S,9R,10R,12R,13R,14R,17S)-3,8,12,14,17-pentahydroxy-10,13-dimethyl-1,2,3,4,7,9,11,12,15,16-decahydrocyclopenta[a]phenanthren-17-yl]ethyl] (E)-3-phenylprop-2-enoate

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Overview

Molecular Formula C30H40O7
Molecular Weight 512.60 g/mol
Canonical SMILES CC(C1(CCC2(C1(C(CC3C2(CC=C4C3(CCC(C4)O)C)O)O)C)O)O)OC(=O)C=CC5=CC=CC=C5

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy