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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP012275

(2S,4S,7R,8S,9S,12R,13R,16R,17S,18R)-16-acetyloxy-2,9,13,17-tetramethyl-7-(4-methyl-2-oxopent-3-enyl)-6-oxo-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-1(20)-ene-17-carboxylic acid

Formula: C32H44O7  |  Mol. Weight: 540.70 g/mol

IUPAC: (2S,4S,7R,8S,9S,12R,13R,16R,17S,18R)-16-acetyloxy-2,9,13,17-tetramethyl-7-(4-methyl-2-oxopent-3-enyl)-6-oxo-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-1(20)-ene-17-carboxylic acid

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Overview

Molecular Formula C32H44O7
Molecular Weight 540.70 g/mol
Canonical SMILES CC(=CC(=O)CC1C2C(CC3(C2(CCC4C3=CCC5C4(CCC(C5(C)C(=O)O)OC(=O)C)C)C)C)OC1=O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy