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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP027634

(2S,3R)-trans-caftaric acid

Formula: C13H12O9  |  Mol. Weight: 312.23 g/mol

IUPAC: (2S,3R)-2-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-3-hydroxybutanedioic acid

Overview

Molecular Formula C13H12O9
Molecular Weight 312.23 g/mol
Canonical SMILES C1=CC(=C(C=C1C=CC(=O)OC(C(C(=O)O)O)C(=O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy