BIMP Logo
SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP007884

[(3S,5S,9R,10R,11R,13R,14R,17R)-17-[(5R)-5-ethyl-6-methylhept-1-en-2-yl]-11-hydroxy-10,13-dimethyl-6-oxo-1,2,3,4,5,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl] benzoate

Formula: C36H50O4  |  Mol. Weight: 546.80 g/mol

IUPAC: [(3S,5S,9R,10R,11R,13R,14R,17R)-17-[(5R)-5-ethyl-6-methylhept-1-en-2-yl]-11-hydroxy-10,13-dimethyl-6-oxo-1,2,3,4,5,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl] benzoate

Overview

Molecular Formula C36H50O4
Molecular Weight 546.80 g/mol
Canonical SMILES CCC(CCC(=C)C1CCC2C1(CC(C3C2=CC(=O)C4C3(CCC(C4)OC(=O)C5=CC=CC=C5)C)O)C)C(C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy