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Substance Name: 3-Methoxyacetaminophen glucuronide
RN: 52092-55-4
UNII: 1T7E27Y792
InChIKey: XLGYMPUDHJPLNR-DKBOKBLXSA-N

Molecular Formula

  • C15-H19-N-O9

Molecular Weight

  • 357.3131
 
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Names and Synonyms

Name of Substance

  • 3-Methoxyacetaminophen glucuronide

Synonyms

  • 3-Methoxyacetaminophen glucuronide
  • 3-Methoxyparacetamol glucuronide
  • beta-D-Glucopyranosiduronic acid, 4-(acetylamino)-2-methoxyphenyl
  • J2.119.224D
  • N-Acetyl-3-methoxy-4-glucuronosidoaniline
  • UNII-1T7E27Y792

Registry Numbers

CAS Registry Number

  • 52092-55-4

FDA UNII

  • 1T7E27Y792

System Generated Number

  • 0052092554

Structure Descriptors

InChI

1S/C15H19NO9/c1-6(17)16-7-3-4-8(9(5-7)23-2)24-15-12(20)10(18)11(19)13(25-15)14(21)22/h3-5,10-13,15,18-20H,1-2H3,(H,16,17)(H,21,22)/t10-,11-,12+,13-,15+/m0/s1

InChIKey

XLGYMPUDHJPLNR-DKBOKBLXSA-N

Smiles

COc1cc(NC(=O)C)ccc1O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(=O)O