BIMP Logo
SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP015049

(3S,3aR,5S,6S,8aS)-3-[(1R,3R,4S)-3-bromo-4-hydroxy-4-methylcyclohexyl]-3,6-dimethyl-1-methylidene-3a,4,5,7,8,8a-hexahydro-2H-azulene-5,6-diol

Formula: C20H33BrO3  |  Mol. Weight: 401.40 g/mol

IUPAC: (3S,3aR,5S,6S,8aS)-3-[(1R,3R,4S)-3-bromo-4-hydroxy-4-methylcyclohexyl]-3,6-dimethyl-1-methylidene-3a,4,5,7,8,8a-hexahydro-2H-azulene-5,6-diol

Overview

Molecular Formula C20H33BrO3
Molecular Weight 401.40 g/mol
Canonical SMILES CC1(CCC2C(CC1O)C(CC2=C)(C)C3CCC(C(C3)Br)(C)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy