1,3,7-tris(hydroxymethyl)-9H-purine-2,6,8-trione

Systemtic Name: 1,3,7-tris(hydroxymethyl)-9H-purine-2,6,8-trione Openeye Name: 1,3,7-tris(hydroxymethyl)-9H-purine-2,6,8-trione CAS Name: 1,3,7-tris(hydroxymethyl)-9H-purine-2,6,8-trione IUPAC Name: 1,3,7-tris(hydroxymethyl)-9H-purine-2,6,8-trione Traditional Name: 1,3,7-trimethylol-9H-purine-2,6,8-trione Formula: C8H10N4O6 MolecularWeight: 258.1882

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Descriptors Computed from Structure

Canonical SMILES:

C(N1C2=C(NC1=O)N(C(=O)N(C2=O)CO)CO)O

Isomeric SMILES

C(N1C2=C(NC1=O)N(C(=O)N(C2=O)CO)CO)O

InChI

InChI=1S/C8H10N4O6/c13-1-10-4-5(9-7(10)17)11(2-14)8(18)12(3-15)6(4)16/h13-15H,1-3H2,(H,9,17)