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Substance Name: Phenobarbital-N-glucoside
RN: 72209-10-0
InChIKey: KKRIJCSEOJCKLM-KBBLASEFSA-N

Molecular Formula

  • C18-H22-N2-O8

Molecular Weight

  • 394.3778
 
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Names and Synonyms

Name of Substance

  • Phenobarbital-N-glucoside

Synonyms

  • 1-(beta-D-Glucopyranosyl)phenobarbital
  • 1-Gppb
  • 5-Ethyl-1-(1-beta-glucopyranosyl)-5-phenyl-2,4,6-(1H,3H,5H)pyrimidinetrione
  • 5-Ethyl-1-beta-D-glucopyranosyl-5-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione

Systematic Name

  • 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1-beta-D-glucopyranosyl-5-phenyl-

Registry Numbers

CAS Registry Number

  • 72209-10-0

System Generated Number

  • 0072209100

Structure Descriptors

InChI

1S/C18H22N2O8/c1-2-18(9-6-4-3-5-7-9)15(25)19-17(27)20(16(18)26)14-13(24)12(23)11(22)10(8-21)28-14/h3-7,10-14,21-24H,2,8H2,1H3,(H,19,25,27)/t10-,11-,12+,13-,14-,18?/m1/s1

InChIKey

KKRIJCSEOJCKLM-KBBLASEFSA-N

Smiles

CCC1(C(=O)NC(=O)N([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C1=O)c3ccccc3