BIMP Logo
SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP009543

(1S,2R,5R,7S,9R,11R,12R,14S,15R,16S)-15-[(1S)-1-[(2R)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]-1-hydroxyethyl]-12,14,15-trihydroxy-5-methoxy-2,16-dimethyl-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadecan-3-one

Formula: C29H42O9  |  Mol. Weight: 534.60 g/mol

IUPAC: (1S,2R,5R,7S,9R,11R,12R,14S,15R,16S)-15-[(1S)-1-[(2R)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]-1-hydroxyethyl]-12,14,15-trihydroxy-5-methoxy-2,16-dimethyl-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadecan-3-one

3D View Find Similar

Overview

Molecular Formula C29H42O9
Molecular Weight 534.60 g/mol
Canonical SMILES CC1=C(C(=O)OC(C1)C(C)(C2(C(CC3(C2(CCC4C3CC5C6(C4(C(=O)CC(C6)OC)C)O5)C)O)O)O)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy