Products 219986-51-3

CAS 219986-51-3 is the registry number for Cimicifugic acid D. Offered by: MedChemExpress. Available pack sizes: Get quote.

Structural formula: {0} (CAS {1})

(2R,3S)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-2-hydroxy-2-[(4-hydroxyphenyl)methyl]butanedioic acid (CAS 219986-51-3) is a chemical compound with the molecular formula C20H18O10 and a molecular weight of 418.3 g/mol. IUPAC name: (2R,3S)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-2-hydroxy-2-[(4-hydroxyphenyl)methyl]butanedioic acid. InChIKey: MTGTYFYLZVUKQG-ZUVWSUMTSA-N.

Identity
Molecular formulaC20H18O10
Molecular weight418.3 g/mol
IUPAC name(2R,3S)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-2-hydroxy-2-[(4-hydroxyphenyl)methyl]butanedioic acid
InChIKeyMTGTYFYLZVUKQG-ZUVWSUMTSA-N
SMILESC1=CC(=CC=C1C[C@@]([C@@H](C(=O)O)OC(=O)/C=C/C2=CC(=C(C=C2)O)O)(C(=O)O)O)O

Computed by PubChem (NCBI)