Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Cryptochlorogenic acid
RN: 87099-73-8
UNII: F23DJ84IZ9
InChIKey: GYFFKZTYYAFCTR-JUHZACGLSA-N

Molecular Formula

  • C16-H18-O9

Molecular Weight

  • 354.3092
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Cryptochlorogenic acid

Synonyms

  • 4-Caffeoylquinic acid
  • 4-Cqa
  • 4-o-Caffeoyl quinic acid
  • Cryptochlorogenic acid
  • Cyclohexanecarboxylic acid, 4-(((2E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl)oxy)-1,3,5-trihydroxy-, (1alpha,3R,4alpha,5R)-
  • Cyclohexanecarboxylic acid, 4-((3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl)oxy)-1,3,5-trihydroxy-, (1alpha,3R,4alpha,5R)-
  • Quinic acid 4-o-caffeate
  • UNII-F23DJ84IZ9

Registry Numbers

CAS Registry Number

  • 87099-73-8

FDA UNII

  • F23DJ84IZ9

System Generated Number

  • 0087099738

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-JUHZACGLSA-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