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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP036507

(3R,5R,8R,9R,10S,11R,13R,14R,17S)-3,11-dihydroxy-17-[(2R)-2-hydroxy-6-methyl-4-oxohept-5-en-2-yl]-4,4,8,10,14-pentamethyl-1,3,5,6,7,9,11,12,13,15,16,17-dodecahydrocyclopenta[a]phenanthren-2-one

Formula: C30H48O5  |  Mol. Weight: 488.70 g/mol

IUPAC: (3R,5R,8R,9R,10S,11R,13R,14R,17S)-3,11-dihydroxy-17-[(2R)-2-hydroxy-6-methyl-4-oxohept-5-en-2-yl]-4,4,8,10,14-pentamethyl-1,3,5,6,7,9,11,12,13,15,16,17-dodecahydrocyclopenta[a]phenanthren-2-one

Overview

Molecular Formula C30H48O5
Molecular Weight 488.70 g/mol
Canonical SMILES CC(=CC(=O)CC(C)(C1CCC2(C1CC(C3C2(CCC4C3(CC(=O)C(C4(C)C)O)C)C)O)C)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy