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Substance Name: 1,2,3,6-Tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-acetic acid,compound with 2-amino-2-(hydroxymethyl)propane-1,3-diol (1:1)
RN: 14358-89-5
InChIKey: XFHXZVGVIBVYMP-UHFFFAOYSA-N

Molecular Formula

  • C9-H10-N4-O4.C4-H11-N-O3

Molecular Weight

  • 359.3369
 
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Names and Synonyms

Synonym

  • EINECS 238-328-3

Systematic Name

  • 1,2,3,6-Tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-acetic acid,compound with 2-amino-2-(hydroxymethyl)propane-1,3-diol (1:1)

Registry Numbers

CAS Registry Number

  • 14358-89-5

System Generated Number

  • 0014358895

Molecular Formulas

Molecular Formula

  • C9-H10-N4-O4.C4-H11-N-O3

Molecular Formula Fragments

  • C4-H11-N-O3
  • C9-H10-N4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C9H10N4O4.C4H11NO3/c1-11-7-6(8(16)12(2)9(11)17)13(4-10-7)3-5(14)15;5-4(1-6,2-7)3-8/h4H,3H2,1-2H3,(H,14,15);6-8H,1-3,5H2

InChIKey

XFHXZVGVIBVYMP-UHFFFAOYSA-N

Smiles

Cn1c2c(c(=O)n(c1=O)C)n(cn2)CC(=O)O.C(C(CO)(CO)N)O