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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP000032

Cimicifugic acid E

Formula: C21H20O10  |  Mol. Weight: 432.40 g/mol

IUPAC: (2R,3S)-2-hydroxy-3-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy-2-[(4-hydroxyphenyl)methyl]butanedioic acid

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Overview

Molecular Formula C21H20O10
Molecular Weight 432.40 g/mol
Canonical SMILES COC1=C(C=CC(=C1)C=CC(=O)OC(C(=O)O)C(CC2=CC=C(C=C2)O)(C(=O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy