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Substance Name: Epicatechin-4'-sulfate
RN: 1038922-78-9
UNII: 4Y7WD8BN8W
InChIKey: YKRWCINYMPRAIG-IUODEOHRSA-N

Molecular Formula

  • C15-H14-O9-S

Molecular Weight

  • 370.3326
 
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Names and Synonyms

Name of Substance

  • Epicatechin-4'-sulfate

Synonyms

  • (-)-Epicatechin 4'-sulfate
  • (2-Hydroxy-4-((2R,3R)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl)phenyl) hydrogen sulfate
  • 2-Hydroxy-4-((2R,3R)-3,5,7-trihydroxychroman-2-yl)phenyl hydrogen sulfate
  • 2H-1-Benzopyran-3,5,7-triol, 3,4-dihydro-2-(3-hydroxy-4-(sulfooxy)phenyl)-, (2R,3R)-
  • Epicatechin 4'-o-sulphate
  • Epicatechin-4'-sulfate
  • UNII-4Y7WD8BN8W

Registry Numbers

CAS Registry Number

  • 1038922-78-9

FDA UNII

  • 4Y7WD8BN8W

System Generated Number

  • 1038922789

Structure Descriptors

InChI

1S/C15H14O9S/c16-8-4-10(17)9-6-12(19)15(23-14(9)5-8)7-1-2-13(11(18)3-7)24-25(20,21)22/h1-5,12,15-19H,6H2,(H,20,21,22)/t12-,15-/m1/s1

InChIKey

YKRWCINYMPRAIG-IUODEOHRSA-N

Smiles

c1cc(c(cc1[C@@H]2[C@@H](Cc3c(cc(cc3O2)O)O)O)O)OS(=O)(=O)O