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zinc 3H-purin-7-id-6-one sulfate dihydrate

zinc 3H-purin-7-id-6-one sulfate dihydrate

Systemtic Name:zinc 3H-purin-7-id-6-one sulfate dihydrate
Openeye Name:zinc 3H-purin-7-id-6-one sulfate dihydrate
CAS Name:zinc 3H-purin-7-id-6-one sulfate dihydrate
IUPAC Name:zinc 3H-purin-7-id-6-one sulfate dihydrate
Traditional Name:zinc 3H-purin-7-id-6-one sulfate dihydrate
Formula: C5H7N4O7SZn-
MolecularWeight: 332.60568
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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=O)C2=C(N1)N=C[N-]2.O.O.[O-]S(=O)(=O)[O-].[Zn+2]


Isomeric SMILES

C1=NC(=O)C2=C(N1)N=C[N-]2.O.O.[O-]S(=O)(=O)[O-].[Zn+2]


InChI

InChI=1S/C5H4N4O.H2O4S.2H2O.Zn/c10-5-3-4(7-1-6-3)8-2-9-5;1-5(2,3)4;;;/h1-2H,(H2,6,7,8,9,10);(H2,1,2,3,4);2*1H2;/q;;;;+2/p-3


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