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Substance Name: Quinic acid
RN: 36413-60-2
InChIKey: AAWZDTNXLSGCEK-DRMQKGJZSA-N

Molecular Formula

  • C7-H12-O6

Molecular Weight

  • 192.166
 
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Names and Synonyms

Results Name

  • Quinic acid

Synonyms

  • AI3-63020
  • EINECS 253-023-5
  • NSC 1115
  • Quinic acid

Systematic Names

  • 1,3,4,5-Tetrahydroxycyclohexanecarboxylic acid (1alpha,3alpha,4alpha,5beta)-
  • Cyclohexanecarboxylic acid, 1,3,4,5-tetrahydroxy-, (1alpha,3alpha,4alpha,5beta)-

Registry Numbers

CAS Registry Number

  • 36413-60-2

Other Registry Number

  • 1010-25-9

System Generated Number

  • 0036413602

Structure Descriptors

InChI

1S/C7H12O6/c8-3-1-7(13,6(11)12)2-4(9)5(3)10/h3-5,8-10,13H,1-2H2,(H,11,12)/t3-,4-,5-,7+/m0/s1

InChIKey

AAWZDTNXLSGCEK-DRMQKGJZSA-N

Smiles

C([C@@]1(C[C@@H]([C@H](O)[C@H](C1)O)O)O)(O)=O