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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP034824

[(1S,3S,5R,6aS,7R,8R,10S,10aS)-1-acetyloxy-10-hydroxy-3-methoxy-7,8-dimethyl-7-[(2E)-3-methylpenta-2,4-dienyl]-1,3,5,6,6a,8,9,10-octahydrobenzo[d][2]benzofuran-5-yl] 2-methylbutanoate

Formula: C28H42O7  |  Mol. Weight: 490.60 g/mol

IUPAC: [(1S,3S,5R,6aS,7R,8R,10S,10aS)-1-acetyloxy-10-hydroxy-3-methoxy-7,8-dimethyl-7-[(2E)-3-methylpenta-2,4-dienyl]-1,3,5,6,6a,8,9,10-octahydrobenzo[d][2]benzofuran-5-yl] 2-methylbutanoate

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Overview

Molecular Formula C28H42O7
Molecular Weight 490.60 g/mol
Canonical SMILES CCC(C)C(=O)OC1CC2C(C(CC(C23C(OC(C3=C1)OC)OC(=O)C)O)C)(C)CC=C(C)C=C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy