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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP015043

[(2S,4aR,4bS,5S,7R,10aS)-5-hydroxy-7-(3-hydroxyprop-1-en-2-yl)-1,1,4a-trimethyl-2,3,4,4b,5,6,7,10a-octahydrophenanthren-2-yl] acetate

Formula: C22H32O4  |  Mol. Weight: 360.50 g/mol

IUPAC: [(2S,4aR,4bS,5S,7R,10aS)-5-hydroxy-7-(3-hydroxyprop-1-en-2-yl)-1,1,4a-trimethyl-2,3,4,4b,5,6,7,10a-octahydrophenanthren-2-yl] acetate

Overview

Molecular Formula C22H32O4
Molecular Weight 360.50 g/mol
Canonical SMILES CC(=O)OC1CCC2(C(C1(C)C)C=CC3=CC(CC(C32)O)C(=C)CO)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy