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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP021484

1,4-Dicaffeoylquinic acid

Formula: C25H24O12  |  Mol. Weight: 516.40 g/mol

IUPAC: (3R,5R)-1,4-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-3,5-dihydroxycyclohexane-1-carboxylic acid

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Overview

Molecular Formula C25H24O12
Molecular Weight 516.40 g/mol
Canonical SMILES C1C(C(C(CC1(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy