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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP000211

(E,6R)-2-methyl-6-[(5R,10S,13R,14R,17R)-4,4,10,13,14-pentamethyl-3-oxo-5,6,7,11,12,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl]hept-2-enoic acid

Formula: C30H44O3  |  Mol. Weight: 452.70 g/mol

IUPAC: (E,6R)-2-methyl-6-[(5R,10S,13R,14R,17R)-4,4,10,13,14-pentamethyl-3-oxo-5,6,7,11,12,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl]hept-2-enoic acid

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Overview

Molecular Formula C30H44O3
Molecular Weight 452.70 g/mol
Canonical SMILES CC(CCC=C(C)C(=O)O)C1CCC2(C1(CCC3=C2CCC4C3(C=CC(=O)C4(C)C)C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy