[(2R,3S,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-2-(phosphonatooxymethyl)oxolan-3-yl] phosphate

Systemtic Name: [(2R,3S,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-2-(phosphonatooxymethyl)oxolan-3-yl] phosphate Openeye Name: [(2R,3S,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-2-(phosphonatooxymethyl)tetrahydrofuran-3-yl] phosphate CAS Name: [(2R,3S,5R)-5-(4-amino-2-oxo-1-pyrimidinyl)-2-(phosphonatooxymethyl)-3-oxolanyl] phosphate IUPAC Name: [(2R,3S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-2-(phosphonatooxymethyl)oxolan-3-yl] phosphate Traditional Name: [(2R,3S,5R)-5-(4-amino-2-keto-pyrimidin-1-yl)-2-(phosphatomethyl)tetrahydrofuran-3-yl] phosphate Formula: C9H11N3O10P2-4 MolecularWeight: 383.145262

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=CC(=NC2=O)N)COP(=O)([O-])[O-])OP(=O)([O-])[O-]

Isomeric SMILES

C1[C@@H]([C@H](O[C@H]1N2C=CC(=NC2=O)N)COP(=O)([O-])[O-])OP(=O)([O-])[O-]

InChI

InChI=1S/C9H15N3O10P2/c10-7-1-2-12(9(13)11-7)8-3-5(22-24(17,18)19)6(21-8)4-20-23(14,15)16/h1-2,5-6,8H,3-4H2,(H2,10,11,13)(H2,14,15,16)(H2,17,18,19)/p-4/t5-,6+,8+/m0/s1