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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP010674

[(1R,3S,3aS,5R,6aR,7S,8S,10R,10aR)-1,3-diacetyloxy-10-hydroxy-7,8-dimethyl-7-[(2E)-3-methylpenta-2,4-dienyl]-1,3,3a,4,5,6,6a,8,9,10-decahydrobenzo[d][2]benzofuran-5-yl] (E)-2-methylbut-2-enoate

Formula: C29H42O8  |  Mol. Weight: 518.60 g/mol

IUPAC: [(1R,3S,3aS,5R,6aR,7S,8S,10R,10aR)-1,3-diacetyloxy-10-hydroxy-7,8-dimethyl-7-[(2E)-3-methylpenta-2,4-dienyl]-1,3,3a,4,5,6,6a,8,9,10-decahydrobenzo[d][2]benzofuran-5-yl] (E)-2-methylbut-2-enoate

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Overview

Molecular Formula C29H42O8
Molecular Weight 518.60 g/mol
Canonical SMILES CC=C(C)C(=O)OC1CC2C(OC(C23C(C1)C(C(CC3O)C)(C)CC=C(C)C=C)OC(=O)C)OC(=O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy