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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP015474

Caseargrewiin C

Formula: C31H44O10  |  Mol. Weight: 576.70 g/mol

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

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Overview

Molecular Formula C31H44O10
Molecular Weight 576.70 g/mol
Canonical SMILES CC1C(C(C23C(C1(C)CC=C(C)C=C)CC(C=C2C(OC3OC(=O)C)OC(=O)C)OC(=O)CC(C)C)O)OC(=O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy