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Substance Name: Genipin 1-gentiobioside
RN: 29307-60-6
UNII: 0NI5399RDZ
InChIKey: FYZYXYLPBWLLGI-AUOPOVQUSA-N

Note

  • From Gardenia fructus (zhi-zi).

Molecular Formula

  • C23-H34-O15

Molecular Weight

  • 550.5066
 
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Names and Synonyms

Name of Substance

  • Genipin 1-gentiobioside

Synonyms

  • GBGB
  • Genipin 1-beta-gentiobioside
  • UNII-0NI5399RDZ

Systematic Name

  • Cyclopenta(c)pyran-4-carboxylic acid, 1-((6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy)-1,4a,5,7a-tetrahydro-7-(hydroxymethyl)-, methyl ester, (1R-(1alpha,4aalpha,7aalpha))-

Registry Numbers

CAS Registry Number

  • 29307-60-6

FDA UNII

  • 0NI5399RDZ

System Generated Number

  • 0029307606

Structure Descriptors

InChI

InChI=1S/C23H34O15/c1-33-20(32)10-6-34-21(13-8(4-24)2-3-9(10)13)38-23-19(31)17(29)15(27)12(37-23)7-35-22-18(30)16(28)14(26)11(5-25)36-22/h2,6,9,11-19,21-31H,3-5,7H2,1H3/t9-,11-,12-,13-,14-,15-,16+,17+,18-,19-,21+,22-,23+/m1/s1

InChIKey

FYZYXYLPBWLLGI-AUOPOVQUSA-N

Smiles

COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)[C@H]4[C@@H]1CC=C4CO