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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP004286

[(E)-2-[[(3aR,4R,9aS,9bR)-6,9-dimethyl-3-methylidene-2-oxo-3a,4,5,7,9a,9b-hexahydroazuleno[4,5-b]furan-4-yl]oxycarbonyl]-4-hydroxybut-2-enyl] (E)-4-hydroxy-2-(hydroxymethyl)but-2-enoate

Formula: C25H30O9  |  Mol. Weight: 474.50 g/mol

IUPAC: [(E)-2-[[(3aR,4R,9aS,9bR)-6,9-dimethyl-3-methylidene-2-oxo-3a,4,5,7,9a,9b-hexahydroazuleno[4,5-b]furan-4-yl]oxycarbonyl]-4-hydroxybut-2-enyl] (E)-4-hydroxy-2-(hydroxymethyl)but-2-enoate

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Overview

Molecular Formula C25H30O9
Molecular Weight 474.50 g/mol
Canonical SMILES CC1=C2CC=C(C2C3C(C(C1)OC(=O)C(=CCO)COC(=O)C(=CCO)CO)C(=C)C(=O)O3)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy