Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1-(2,4,6-Trichlorophenyl)-3-methyl-O-(triazenylmethyl)glucuronic acid
RN: 72040-50-7
InChIKey: YTMCIHZHJQPZNT-RAUKCWHVSA-N

Note

  • Urinary metabolite of 1-(2,4,6-trichlorophenyl)-3,3-.

Classification Code

  • Mutation Data

Molecular Formula

  • C14-H19-N3-O7

Molecular Weight

  • 444.6534
 
* 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

  • 1-(2,4,6-Trichlorophenyl)-3-methyl-O-(triazenylmethyl)glucuronic acid

Synonym

  • (1-Methyl-3-(2,4,6-trichlorophenyl)-2-triazeno)methyl-beta-D-glucopyranoside uronic acid

Systematic Names

  • beta-D-Glucopyranosiduronic acid, (1-methyl-3-(2,4,6-trichlorophenyl)-2-triazenyl)methyl
  • Glucopyranosiduronic acid, 1-((1-methyl-3-(2,4,6-trichlorophenyl)-2-triazeno)methyl)-, beta-D-

Registry Numbers

CAS Registry Number

  • 72040-50-7

System Generated Number

  • 0072040507

Structure Descriptors

InChI

1S/C14H16Cl3N3O7/c1-20(19-18-8-6(16)2-5(15)3-7(8)17)4-26-14-11(23)9(21)10(22)12(27-14)13(24)25/h2-3,9-12,14,21-23H,4H2,1H3,(H,24,25)/b19-18+/t9-,10-,11+,12-,14+/m0/s1

InChIKey

YTMCIHZHJQPZNT-RAUKCWHVSA-N

Smiles

CN(CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C(=O)O)O)O)O)/N=N/c2c(cc(cc2Cl)Cl)Cl