[[3-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)cyclobutyl]methoxy-oxidanyl-phosphoryl] phosphono hydrogen phosphate

Systemtic Name: [[3-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)cyclobutyl]methoxy-oxidanyl-phosphoryl] phosphono hydrogen phosphate Openeye Name: [[3-(2-amino-6-oxo-3H-purin-9-yl)cyclobutyl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate CAS Name: [[3-(2-amino-6-oxo-3H-purin-9-yl)cyclobutyl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate IUPAC Name: [[3-(2-amino-6-oxo-3H-purin-9-yl)cyclobutyl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate Traditional Name: [[3-(2-amino-6-keto-3H-purin-9-yl)cyclobutyl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate Formula: C10H16N5O11P3 MolecularWeight: 475.182223

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC1N2C=NC3=C2NC(=NC3=O)N)COP(=O)(O)OP(=O)(O)OP(=O)(O)O

Isomeric SMILES

C1C(CC1N2C=NC3=C2NC(=NC3=O)N)COP(=O)(O)OP(=O)(O)OP(=O)(O)O

InChI

InChI=1S/C10H16N5O11P3/c11-10-13-8-7(9(16)14-10)12-4-15(8)6-1-5(2-6)3-24-28(20,21)26-29(22,23)25-27(17,18)19/h4-6H,1-3H2,(H,20,21)(H,22,23)(H2,17,18,19)(H3,11,13,14,16)