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1-oxidanyl-3,7-dihydropurine-2,6-dione dihydrate

1-oxidanyl-3,7-dihydropurine-2,6-dione dihydrate

Systemtic Name:1-oxidanyl-3,7-dihydropurine-2,6-dione dihydrate
Openeye Name:1-hydroxy-3,7-dihydropurine-2,6-dione dihydrate
CAS Name:1-hydroxy-3,7-dihydropurine-2,6-dione dihydrate
IUPAC Name:1-hydroxy-3,7-dihydropurine-2,6-dione dihydrate
Traditional Name:1-hydroxy-7H-xanthine dihydrate
Formula: C5H8N4O5
MolecularWeight: 204.14082
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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1)C(=O)N(C(=O)N2)O.O.O


Isomeric SMILES

C1=NC2=C(N1)C(=O)N(C(=O)N2)O.O.O


InChI

InChI=1S/C5H4N4O3.2H2O/c10-4-2-3(7-1-6-2)8-5(11)9(4)12;;/h1,12H,(H,6,7)(H,8,11);2*1H2


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