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

Systemtic Name: [5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-2-(hydroxymethyl)-4-(2-methoxyethoxy)oxolan-3-yl] dihydrogen phosphate Openeye Name: [5-(2-amino-6-oxo-3H-purin-9-yl)-2-(hydroxymethyl)-4-(2-methoxyethoxy)tetrahydrofuran-3-yl] dihydrogen phosphate CAS Name: [5-(2-amino-6-oxo-3H-purin-9-yl)-2-(hydroxymethyl)-4-(2-methoxyethoxy)-3-oxolanyl] dihydrogen phosphate IUPAC Name: [5-(2-amino-6-oxo-3H-purin-9-yl)-2-(hydroxymethyl)-4-(2-methoxyethoxy)oxolan-3-yl] dihydrogen phosphate Traditional Name: [5-(2-amino-6-keto-3H-purin-9-yl)-4-(2-methoxyethoxy)-2-methylol-tetrahydrofuran-3-yl] dihydrogen phosphate Formula: C13H20N5O9P MolecularWeight: 421.299761

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1C(C(OC1N2C=NC3=C2NC(=NC3=O)N)CO)OP(=O)(O)O

Isomeric SMILES

COCCOC1C(C(OC1N2C=NC3=C2NC(=NC3=O)N)CO)OP(=O)(O)O

InChI

InChI=1S/C13H20N5O9P/c1-24-2-3-25-9-8(27-28(21,22)23)6(4-19)26-12(9)18-5-15-7-10(18)16-13(14)17-11(7)20/h5-6,8-9,12,19H,2-4H2,1H3,(H2,21,22,23)(H3,14,16,17,20)