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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP035403

3-[(1S,4R,5R,8S,9S,12S,13R)-5-[(3S,6R)-6-[(2R)-1,2-dihydroxypropan-2-yl]oxan-3-yl]-4,8-dimethyl-12-prop-1-en-2-yl-13-tetracyclo[7.5.0.01,13.04,8]tetradecanyl]propanoic acid

Formula: C30H48O5  |  Mol. Weight: 488.70 g/mol

IUPAC: 3-[(1S,4R,5R,8S,9S,12S,13R)-5-[(3S,6R)-6-[(2R)-1,2-dihydroxypropan-2-yl]oxan-3-yl]-4,8-dimethyl-12-prop-1-en-2-yl-13-tetracyclo[7.5.0.01,13.04,8]tetradecanyl]propanoic acid

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Overview

Molecular Formula C30H48O5
Molecular Weight 488.70 g/mol
Canonical SMILES CC(=C)C1CCC2C3(CCC(C3(CCC24C1(C4)CCC(=O)O)C)C5CCC(OC5)C(C)(CO)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy