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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP013085

(2S)-2-[(3S,4S,5R,9R,10R,13S,14S,17S)-3-hydroxy-4-(hydroxymethyl)-4,10,13,14-tetramethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylhept-5-enoic acid

Formula: C30H48O4  |  Mol. Weight: 472.70 g/mol

IUPAC: (2S)-2-[(3S,4S,5R,9R,10R,13S,14S,17S)-3-hydroxy-4-(hydroxymethyl)-4,10,13,14-tetramethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylhept-5-enoic acid

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Overview

Molecular Formula C30H48O4
Molecular Weight 472.70 g/mol
Canonical SMILES CC(=CCCC(C1CCC2(C1(CCC3C2=CCC4C3(CCC(C4(C)CO)O)C)C)C)C(=O)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy