2-azanyl-5-methyl-1,6-dihydropteridin-4-one; phosphono dihydrogen phosphate

Systemtic Name: 2-azanyl-5-methyl-1,6-dihydropteridin-4-one; phosphono dihydrogen phosphate Openeye Name: 2-amino-5-methyl-1,6-dihydropteridin-4-one; phosphono dihydrogen phosphate CAS Name: 2-amino-5-methyl-1,6-dihydropteridin-4-one; phosphono dihydrogen phosphate IUPAC Name: 2-amino-5-methyl-1,6-dihydropteridin-4-one; phosphono dihydrogen phosphate Traditional Name: 2-amino-5-methyl-1,6-dihydropteridin-4-one; phosphono dihydrogen phosphate Formula: C7H13N5O8P2 MolecularWeight: 357.154342

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC=NC2=C1C(=O)N=C(N2)N.OP(=O)(O)OP(=O)(O)O

Isomeric SMILES

CN1CC=NC2=C1C(=O)N=C(N2)N.OP(=O)(O)OP(=O)(O)O

InChI

InChI=1S/C7H9N5O.H4O7P2/c1-12-3-2-9-5-4(12)6(13)11-7(8)10-5;1-8(2,3)7-9(4,5)6/h2H,3H2,1H3,(H3,8,10,11,13);(H2,1,2,3)(H2,4,5,6)