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Substance Name: Geniposidic acid
RN: 27741-01-1
InChIKey: ZJDOESGVOWAULF-OGJQONSISA-N

Note

  • From Gardenia fructus (zhi-zi).

Molecular Formula

  • C16-H22-O10

Molecular Weight

  • 374.3398
 
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Names and Synonyms

Name of Substance

  • Geniposidic acid

Systematic Names

  • Cyclopenta(c)pyran-4-carboxylic acid, 1-(beta-D-glucopyranosyloxy)-1,4a,5,7a-tetrahydro-7-(hydroxymethyl)-, (1S,4aS,7aS)-
  • Cyclopenta(c)pyran-4-carboxylic acid, 1-(beta-D-glucopyranosyloxy)-1,4a,5,7a-tetrahydro-7-(hydroxymethyl)-, (1S-(1alpha,4aalpha,7aalpha))-

Registry Numbers

CAS Registry Number

  • 27741-01-1

System Generated Number

  • 0027741011

Structure Descriptors

InChI

1S/C16H22O10/c17-3-6-1-2-7-8(14(22)23)5-24-15(10(6)7)26-16-13(21)12(20)11(19)9(4-18)25-16/h1,5,7,9-13,15-21H,2-4H2,(H,22,23)/t7-,9-,10-,11-,12+,13-,15+,16+/m1/s1

InChIKey

ZJDOESGVOWAULF-OGJQONSISA-N

Smiles

C1C=C([C@@H]2[C@H]1C(=CO[C@H]2O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)C(=O)O)CO