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Substance Name: Lamotrigine 2-N-glucuronide
RN: 133310-19-7
InChIKey: IEVMENHZPOWVGO-XPORZQOISA-O

Note

  • Major metabolite of lamotrigine.

Molecular Formula

  • C15-H16-Cl2-N5-O6

Molecular Weight

  • 433.226
 
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Names and Synonyms

Name of Substance

  • Lamotrigine 2-N-glucuronide

Systematic Name

  • 1,2,4-Triazinium, 3,5-diamino-6-(2,3-dichlorophenyl)-2-beta-D-glucopyranuronosyl-

Registry Numbers

CAS Registry Number

  • 133310-19-7

System Generated Number

  • 0133310197

Structure Descriptors

InChI

1S/C15H15Cl2N5O6/c16-5-3-1-2-4(6(5)17)7-12(18)20-15(19)22(21-7)13-10(25)8(23)9(24)11(28-13)14(26)27/h1-3,8-11,13,23-25H,(H4,18,19,20,26,27)/p+1/t8-,9-,10+,11-,13+/m0/s1

InChIKey

IEVMENHZPOWVGO-XPORZQOISA-O

Smiles

c1ccc(c(c1Cl)Cl)c1c(nc(N)[n+]([C@@H]2O[C@@H]([C@H]([C@@H]([C@H]2O)O)O)C(O)=O)n1)N