BIMP Logo
SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP031442

[(3aR,4R,5aR,6R,9S,9aS,9bR)-6-hydroxy-5a,9-dimethyl-3-methylidene-2,8-dioxo-3a,4,5,6,7,9,9a,9b-octahydrobenzo[g][1]benzofuran-4-yl] (E)-2-(hydroxymethyl)-4-(2-hydroxy-3-methylbutanoyl)oxybut-2-enoate

Formula: C25H34O10  |  Mol. Weight: 494.50 g/mol

IUPAC: [(3aR,4R,5aR,6R,9S,9aS,9bR)-6-hydroxy-5a,9-dimethyl-3-methylidene-2,8-dioxo-3a,4,5,6,7,9,9a,9b-octahydrobenzo[g][1]benzofuran-4-yl] (E)-2-(hydroxymethyl)-4-(2-hydroxy-3-methylbutanoyl)oxybut-2-enoate

3D View Find Similar

Overview

Molecular Formula C25H34O10
Molecular Weight 494.50 g/mol
Canonical SMILES CC1C2C3C(C(CC2(C(CC1=O)O)C)OC(=O)C(=CCOC(=O)C(C(C)C)O)CO)C(=C)C(=O)O3

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy