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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP028403

[(3R,3aS,6S,6aS,7S,10aR)-3-acetyloxy-7-[(3S)-3-acetyloxy-4-hydroxy-4-methylpentyl]-7-methyl-4-methylidene-3,3a,5,6,6a,8,9,10-octahydro-1H-benzo[d][2]benzofuran-6-yl] acetate

Formula: C26H40O8  |  Mol. Weight: 480.60 g/mol

IUPAC: [(3R,3aS,6S,6aS,7S,10aR)-3-acetyloxy-7-[(3S)-3-acetyloxy-4-hydroxy-4-methylpentyl]-7-methyl-4-methylidene-3,3a,5,6,6a,8,9,10-octahydro-1H-benzo[d][2]benzofuran-6-yl] acetate

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Overview

Molecular Formula C26H40O8
Molecular Weight 480.60 g/mol
Canonical SMILES CC(=O)OC1CC(=C)C2C(OCC23C1C(CCC3)(C)CCC(C(C)(C)O)OC(=O)C)OC(=O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy