Products 223614-70-8

CAS 223614-70-8 is the registry number for Epicatechin 5-O-beta-D-glucuronide. Offered by: TRC. Available pack sizes: 25mg.

Epicatechin 5-O-beta-D-glucuronide
TRC
  • size: 25mg
  • Variants: 1
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Structural formula: {0} (CAS {1})

(2S,3S,4S,5R,6S)-6-[[(2R,3R)-2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2H-chromen-5-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid (CAS 223614-70-8) is a chemical compound with the molecular formula C21H22O12 and a molecular weight of 466.4 g/mol. IUPAC name: (2S,3S,4S,5R,6S)-6-[[(2R,3R)-2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2H-chromen-5-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid. InChIKey: KGLMKAPOVXBIJB-CVPXIJHMSA-N.

Identity
Molecular formulaC21H22O12
Molecular weight466.4 g/mol
IUPAC name(2S,3S,4S,5R,6S)-6-[[(2R,3R)-2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2H-chromen-5-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
InChIKeyKGLMKAPOVXBIJB-CVPXIJHMSA-N
SMILESC1[C@H]([C@H](OC2=C1C(=CC(=C2)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O)C4=CC(=C(C=C4)O)O)O

Computed by PubChem (NCBI)

Synonyms: Epicatechin 5-O-?-D-glucuronide, Epicatechin 5-O-glucuronide
Isomers (same molecular formula)
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[2-hydroxy-5-[(2R,3R)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl]phenoxy]oxane-2-carboxylic acid C21H22O12