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Substance Name: 2-Pyridinehiol 1-oxide glucuronide
RN: 33776-71-5
InChIKey: RNCPPZVWYCPYEB-UBVHSMIISA-N

Molecular Formula

  • C11-H14-N-O7-S

Molecular Weight

  • 304.298
 
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Names and Synonyms

Results Name

  • 2-Pyridinehiol 1-oxide glucuronide

Synonyms

  • (2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-((1-oxido-2H-pyridin-6-yl)sulfanyl)oxane-2-carboxylic acid
  • 2-Pyridinehiol 1-oxide glucuronide

Systematic Name

  • beta-D-Glucopyranosiduronic acid, 1-oxido-2-pyridinyl 1-thio-

Registry Numbers

CAS Registry Number

  • 33776-71-5

System Generated Number

  • 0033776715

Structure Descriptors

InChI

1S/C11H14NO7S/c13-6-7(14)9(10(16)17)19-11(8(6)15)20-5-3-1-2-4-12(5)18/h1-3,6-9,11,13-15H,4H2,(H,16,17)/q-1/t6-,7-,8+,9-,11-/m0/s1

InChIKey

RNCPPZVWYCPYEB-UBVHSMIISA-N

Smiles

S([C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)C(=O)O)C1=CC=CCN1[O-]