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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP035228

methyl 3-[(1S,4R,5R,8S,9S,12R,13R)-5-[(Z,2R)-1,7-dihydroxy-6-methylhept-5-en-2-yl]-12-(2-hydroxypropan-2-yl)-4,8-dimethyl-13-tetracyclo[7.5.0.01,13.04,8]tetradecanyl]propanoate

Formula: C31H52O5  |  Mol. Weight: 504.70 g/mol

IUPAC: methyl 3-[(1S,4R,5R,8S,9S,12R,13R)-5-[(Z,2R)-1,7-dihydroxy-6-methylhept-5-en-2-yl]-12-(2-hydroxypropan-2-yl)-4,8-dimethyl-13-tetracyclo[7.5.0.01,13.04,8]tetradecanyl]propanoate

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Overview

Molecular Formula C31H52O5
Molecular Weight 504.70 g/mol
Canonical SMILES CC(=CCCC(CO)C1CCC2(C1(CCC34C2CCC(C3(C4)CCC(=O)OC)C(C)(C)O)C)C)CO

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy