Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Tolcapone 5-amino-3-O-sulfate
RN: 254902-29-9
UNII: 0Y220T70EG
InChIKey: XXEISDBRYZQIMM-UHFFFAOYSA-N

Molecular Formula

  • C14-H13-N-O6-S

Molecular Weight

  • 323.3237
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Tolcapone 5-amino-3-O-sulfate

Synonyms

  • 5-Amino tolcapone-3-o-sulphate
  • Methanone, (3-amino-4-hydroxy-5-(sulfooxy)phenyl)(4-methylphenyl)-
  • Tolcapone 5-amino-3-O-sulfate
  • UNII-0Y220T70EG

Registry Numbers

CAS Registry Number

  • 254902-29-9

FDA UNII

  • 0Y220T70EG

System Generated Number

  • 0254902299

Structure Descriptors

InChI

1S/C14H13NO6S/c1-8-2-4-9(5-3-8)13(16)10-6-11(15)14(17)12(7-10)21-22(18,19)20/h2-7,17H,15H2,1H3,(H,18,19,20)

InChIKey

XXEISDBRYZQIMM-UHFFFAOYSA-N

Smiles

Cc1ccc(cc1)C(=O)c2cc(c(c(c2)OS(=O)(=O)O)O)N