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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP017633

Cimicifugic acid D

Formula: C20H18O10  |  Mol. Weight: 418.30 g/mol

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

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Overview

Molecular Formula C20H18O10
Molecular Weight 418.30 g/mol
Canonical SMILES C1=CC(=CC=C1CC(C(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)(C(=O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy