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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP012808

quadrangularic acid H

Formula: C30H44O7  |  Mol. Weight: 516.70 g/mol

IUPAC: (1S,3S,4S,6S,7S,8R,11S,12S,15R,16R)-15-[(1R)-1-carboxy-5-methyl-4-oxohex-5-enyl]-4,6-dihydroxy-7,12,16-trimethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecane-7-carboxylic acid

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Overview

Molecular Formula C30H44O7
Molecular Weight 516.70 g/mol
Canonical SMILES CC(=C)C(=O)CCC(C1CCC2(C1(CCC34C2CCC5C3(C4)C(CC(C5(C)C(=O)O)O)O)C)C)C(=O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy