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Substance Name: Fluconazole glucuronide
RN: 136134-23-1
UNII: 2KH0107L73
InChIKey: GJQIGLSHRFZUJD-RPUYLAQPSA-N

Molecular Formula

  • C19-H20-F2-N6-O7

Molecular Weight

  • 482.398
 
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Names and Synonyms

Name of Substance

  • Fluconazole glucuronide

Synonyms

  • beta-D-Glucopyranosiduronic acid, 1-(2,4-difluorophenyl)-2-(1H-1,2,4-triazol-1-yl)-1-(1H-1,2,4-triazol-1-ylmethyl)ethyl
  • Fluconazole beta-D-glucuronide
  • Fluconazole glucuronide
  • UNII-2KH0107L73

Registry Numbers

CAS Registry Number

  • 136134-23-1

FDA UNII

  • 2KH0107L73

System Generated Number

  • 0136134231

Structure Descriptors

InChI

1S/C19H20F2N6O7/c20-10-1-2-11(12(21)3-10)19(4-26-8-22-6-24-26,5-27-9-23-7-25-27)34-18-15(30)13(28)14(29)16(33-18)17(31)32/h1-3,6-9,13-16,18,28-30H,4-5H2,(H,31,32)/t13-,14-,15+,16-,18-/m0/s1

InChIKey

GJQIGLSHRFZUJD-RPUYLAQPSA-N

Smiles

c1cc(c(cc1F)F)C(Cn2cncn2)(Cn3cncn3)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O