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Substance Name: Cryptochlorogenic acid, (Z)-
RN: 87099-76-1
UNII: 765J6E4RXD
InChIKey: GYFFKZTYYAFCTR-XYXZIBEBSA-N

Molecular Formula

  • C16-H18-O9

Molecular Weight

  • 354.3092
 
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Names and Synonyms

Name of Substance

  • Cryptochlorogenic acid, (Z)-

Synonyms

  • cis-4-Caffeoylquinic acid
  • cis-4-Cqa
  • cis-4-o-Caffeoylquinic acid
  • Cryptochlorogenic acid, (Z)-
  • Cyclohexanecarboxylic acid, 4-(((2Z)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl)oxy)-1,3,5-trihydroxy-, (1alpha,3R,4alpha,5R)-
  • UNII-765J6E4RXD

Registry Numbers

CAS Registry Number

  • 87099-76-1

FDA UNII

  • 765J6E4RXD

System Generated Number

  • 0087099761

Structure Descriptors

InChI

1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-14-11(19)6-16(24,15(22)23)7-12(14)20/h1-5,11-12,14,17-20,24H,6-7H2,(H,22,23)/b4-2-/t11-,12-,14-,16+/m1/s1

InChIKey

GYFFKZTYYAFCTR-XYXZIBEBSA-N

Smiles

O[C@@H]1C[C@@](O)(C[C@@H](O)[C@H]1OC(=O)\C=C/c2ccc(O)c(O)c2)C(=O)O