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Substance Name: N-(4-(5-Imino-7-oxo-4,5,6,7-tetrahydro-2H-(1,2,3)triazolo(4,5-d)pyrimidin-2-yl)benzoyl)glutamic acid
RN: 6329-09-5
InChIKey: PZCBWFSIGBZHGN-UHFFFAOYSA-N

Molecular Formula

  • C16-H15-N7-O6

Molecular Weight

  • 401.3375
 
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Names and Synonyms

  • N-(4-(5-Imino-7-oxo-4,5,6,7-tetrahydro-2H-(1,2,3)triazolo(4,5-d)pyrimidin-2-yl)benzoyl)glutamic acid

Registry Numbers

CAS Registry Number

  • 6329-09-5

System Generated Number

  • 0006329095

Structure Descriptors

InChI

1S/C16H15N7O6/c17-16-19-12-11(14(27)20-16)21-23(22-12)8-3-1-7(2-4-8)13(26)18-9(15(28)29)5-6-10(24)25/h1-4,9H,5-6H2,(H,18,26)(H,24,25)(H,28,29)(H3,17,19,20,22,27)

InChIKey

PZCBWFSIGBZHGN-UHFFFAOYSA-N

Smiles

c12c(nn(n1)c1ccc(C(=O)NC(C(=O)O)CCC(=O)O)cc1)c(=O)[nH]c(=N)[nH]2