7H-purin-6-amine diphosphate

Systemtic Name: 7H-purin-6-amine diphosphate Openeye Name: 7H-purin-6-amine diphosphate CAS Name: 7H-purin-6-amine diphosphate IUPAC Name: 7H-purin-6-amine diphosphate Traditional Name: 7H-adenine diphosphate Formula: C5H5N5O8P2-6 MolecularWeight: 325.069422

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1)C(=NC=N2)N.[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-]

Isomeric SMILES

C1=NC2=C(N1)C(=NC=N2)N.[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C5H5N5.2H3O4P/c6-4-3-5(9-1-7-3)10-2-8-4;2*1-5(2,3)4/h1-2H,(H3,6,7,8,9,10);2*(H3,1,2,3,4)/p-6