[5-(hydroxymethyl)-4-oxidanyl-2-(6-oxidanylidene-3H-purin-9-yl)oxolan-3-yl] dihydrogen phosphate

Systemtic Name: [5-(hydroxymethyl)-4-oxidanyl-2-(6-oxidanylidene-3H-purin-9-yl)oxolan-3-yl] dihydrogen phosphate Openeye Name: [4-hydroxy-5-(hydroxymethyl)-2-(6-oxo-3H-purin-9-yl)tetrahydrofuran-3-yl] dihydrogen phosphate CAS Name: [4-hydroxy-5-(hydroxymethyl)-2-(6-oxo-3H-purin-9-yl)-3-oxolanyl] dihydrogen phosphate IUPAC Name: [4-hydroxy-5-(hydroxymethyl)-2-(6-oxo-3H-purin-9-yl)oxolan-3-yl] dihydrogen phosphate Traditional Name: [4-hydroxy-2-(6-keto-3H-purin-9-yl)-5-methylol-tetrahydrofuran-3-yl] dihydrogen phosphate Formula: C10H13N4O8P MolecularWeight: 348.205981

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=O)C2=C(N1)N(C=N2)C3C(C(C(O3)CO)O)OP(=O)(O)O

Isomeric SMILES

C1=NC(=O)C2=C(N1)N(C=N2)C3C(C(C(O3)CO)O)OP(=O)(O)O

InChI

InChI=1S/C10H13N4O8P/c15-1-4-6(16)7(22-23(18,19)20)10(21-4)14-3-13-5-8(14)11-2-12-9(5)17/h2-4,6-7,10,15-16H,1H2,(H,11,12,17)(H2,18,19,20)