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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP002798

(2S)-2-[(3S,5R,10S,12R,13R,14S,17R)-3,12-dihydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]propanoic acid

Formula: C25H38O4  |  Mol. Weight: 402.60 g/mol

IUPAC: (2S)-2-[(3S,5R,10S,12R,13R,14S,17R)-3,12-dihydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]propanoic acid

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Overview

Molecular Formula C25H38O4
Molecular Weight 402.60 g/mol
Canonical SMILES CC(C1CCC2(C1(C(C=C3C2=CCC4C3(CCC(C4(C)C)O)C)O)C)C)C(=O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy