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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP020706

Phaseolus epsilon

Formula: C25H34O12  |  Mol. Weight: 526.50 g/mol

IUPAC: (1R,2R,5S,8S,9S,10R,11S,12R,13S)-5,12-dihydroxy-11-methyl-6-methylidene-16-oxo-13-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-9-carboxylic acid

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Overview

Molecular Formula C25H34O12
Molecular Weight 526.50 g/mol
Canonical SMILES CC12C3C(C45CC(=C)C(C4)(CCC5C3(CC(C1O)OC6C(C(C(C(O6)CO)O)O)O)OC2=O)O)C(=O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy