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Substance Name: Indican (urinary)
RN: 2642-37-7
UNII: 567HMW942W
InChIKey: MDAWATNFDJIBBD-UHFFFAOYSA-M

Classification Code

  • Tumor Data

Molecular Formulas

  • C8-H6-N-O4-S.K
  • C8-H7-N-O4-S.K

Molecular Weight

  • 251.302
 
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Names and Synonyms

Results Name

  • Indican (urinary)

Name of Substance

  • Potassium indoxyl sulfate

Synonyms

  • 3-Indoxylsulfuric acid, potassium salt
  • EINECS 220-145-5
  • Indol-3-ol, potassium sulfate
  • Indol-3-yl potassium sulfate
  • Indol-3-yl sulfate, potassium salt
  • Potassium indol-3-yl sulfate
  • UNII-567HMW942W
  • Urinary indican

Systematic Names

  • Indol-3-ol, hydrogen sulfate (ester), potassium salt
  • Potassium indol-3-yl sulphate

Registry Numbers

CAS Registry Number

  • 2642-37-7

FDA UNII

  • 567HMW942W

Other Registry Number

  • 1309597-66-7

Related Registry Number

  • 487-94-5 (Parent)

System Generated Number

  • 0002642377

Molecular Formulas

Molecular Formulas

  • C8-H6-N-O4-S.K
  • C8-H7-N-O4-S.K

Molecular Formula Fragments

  • C8-H6-N-O4-S
  • C8-H7-N-O4-S
  • COMPONENT
  • K

Structure Descriptors

InChI

1S/C8H7NO4S.K/c10-14(11,12)13-8-5-9-7-4-2-1-3-6(7)8;/h1-5,9H,(H,10,11,12);/q;+1/p-1

InChIKey

MDAWATNFDJIBBD-UHFFFAOYSA-M

Smiles

c12c(c[nH]c1cccc2)OS(=O)(=O)[O-].[K+]