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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP010514

Casearborin E

Formula: C33H40O10  |  Mol. Weight: 596.70 g/mol

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

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Overview

Molecular Formula C33H40O10
Molecular Weight 596.70 g/mol
Canonical SMILES CC1CC(C23C(C1(C)CC=C(C)C=C)CC(C=C2C(OC3OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C4=CC=C(C=C4)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy