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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP007469

Methyl 5-O-feruloylquinate

Formula: C18H22O9  |  Mol. Weight: 382.40 g/mol

IUPAC: methyl (1R,3R,4S,5R)-1,3,4-trihydroxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylate

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Overview

Molecular Formula C18H22O9
Molecular Weight 382.40 g/mol
Canonical SMILES COC1=C(C=CC(=C1)C=CC(=O)OC2CC(CC(C2O)O)(C(=O)OC)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy