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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP001221

[(1S,4S,5S,5aS,9aS,9bR)-1,4-diacetyloxy-6,6,9a-trimethyl-1,4,5,5a,7,8,9,9b-octahydrobenzo[e][2]benzofuran-5-yl] acetate

Formula: C21H30O7  |  Mol. Weight: 394.50 g/mol

IUPAC: [(1S,4S,5S,5aS,9aS,9bR)-1,4-diacetyloxy-6,6,9a-trimethyl-1,4,5,5a,7,8,9,9b-octahydrobenzo[e][2]benzofuran-5-yl] acetate

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Overview

Molecular Formula C21H30O7
Molecular Weight 394.50 g/mol
Canonical SMILES CC(=O)OC1C(C2=COC(C2C3(C1C(CCC3)(C)C)C)OC(=O)C)OC(=O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy