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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP019140

methyl 2-[(2R)-2-[(1aR,7aS)-4,5-diacetyloxy-3-(furan-3-yl)-3a-methyl-7-methylidene-1a,2,3,4,5,6-hexahydroindeno[1,7a-b]oxiren-6-yl]-2,6,6-trimethyl-5-oxocyclohex-3-en-1-yl]-2-acetyloxyacetate

Formula: C33H40O11  |  Mol. Weight: 612.70 g/mol

IUPAC: methyl 2-[(2R)-2-[(1aR,7aS)-4,5-diacetyloxy-3-(furan-3-yl)-3a-methyl-7-methylidene-1a,2,3,4,5,6-hexahydroindeno[1,7a-b]oxiren-6-yl]-2,6,6-trimethyl-5-oxocyclohex-3-en-1-yl]-2-acetyloxyacetate

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Overview

Molecular Formula C33H40O11
Molecular Weight 612.70 g/mol
Canonical SMILES CC(=O)OC1C(C(=C)C23C(O2)CC(C3(C1OC(=O)C)C)C4=COC=C4)C5(C=CC(=O)C(C5C(C(=O)OC)OC(=O)C)(C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy