[[(2S,3S,5R)-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-oxidanyl-oxolan-2-yl]-phosphonooxy-methyl] phosphono hydrogen phosphate

Systemtic Name: [[(2S,3S,5R)-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-oxidanyl-oxolan-2-yl]-phosphonooxy-methyl] phosphono hydrogen phosphate Openeye Name: [[(2S,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]-phosphonooxy-methyl] phosphono hydrogen phosphate CAS Name: [[(2S,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2-oxolanyl]-phosphonooxymethyl] phosphono hydrogen phosphate IUPAC Name: [[(2S,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]-phosphonooxymethyl] phosphono hydrogen phosphate Traditional Name: [[(2S,3S,5R)-5-(2,4-diketo-5-methyl-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]-phosphonooxy-methyl] phosphono hydrogen phosphate Formula: C10H17N2O15P3 MolecularWeight: 498.167663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C2CC(C(O2)C(OP(=O)(O)O)OP(=O)(O)OP(=O)(O)O)O

Isomeric SMILES

CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)C(OP(=O)(O)O)OP(=O)(O)OP(=O)(O)O)O

InChI

InChI=1S/C10H17N2O15P3/c1-4-3-12(10(15)11-8(4)14)6-2-5(13)7(24-6)9(25-28(16,17)18)26-30(22,23)27-29(19,20)21/h3,5-7,9,13H,2H2,1H3,(H,22,23)(H,11,14,15)(H2,16,17,18)(H2,19,20,21)/t5-,6+,7-,9?/m0/s1