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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP022445

[(1S,3R,5R,6aS,7R,8R,10aS)-1-acetyloxy-5-hydroxy-7,8-dimethyl-7-(3-methylidenepent-4-enyl)-1,3,5,6,6a,8,9,10-octahydrobenzo[d][2]benzofuran-3-yl] butanoate

Formula: C26H38O6  |  Mol. Weight: 446.60 g/mol

IUPAC: [(1S,3R,5R,6aS,7R,8R,10aS)-1-acetyloxy-5-hydroxy-7,8-dimethyl-7-(3-methylidenepent-4-enyl)-1,3,5,6,6a,8,9,10-octahydrobenzo[d][2]benzofuran-3-yl] butanoate

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Overview

Molecular Formula C26H38O6
Molecular Weight 446.60 g/mol
Canonical SMILES CCCC(=O)OC1C2=CC(CC3C2(CCC(C3(C)CCC(=C)C=C)C)C(O1)OC(=O)C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy