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

Systemtic Name: [[(2R,3S,5R)-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-oxidanyl-2-propanoyl-oxolan-2-yl]methoxy-oxidanyl-phosphoryl] phosphono hydrogen phosphate Openeye Name: [hydroxy-[[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)-2-propanoyl-tetrahydrofuran-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate CAS Name: [hydroxy-[[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2-(1-oxopropyl)-2-oxolanyl]methoxy]phosphoryl] phosphono hydrogen phosphate IUPAC Name: [hydroxy-[[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-2-propanoyloxolan-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate Traditional Name: [[(2R,3S,5R)-5-(2,4-diketo-5-methyl-pyrimidin-1-yl)-3-hydroxy-2-propionyl-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate Formula: C13H21N2O15P3 MolecularWeight: 538.231523

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1(C(CC(O1)N2C=C(C(=O)NC2=O)C)O)COP(=O)(O)OP(=O)(O)OP(=O)(O)O

Isomeric SMILES

CCC(=O)[C@]1([C@H](C[C@@H](O1)N2C=C(C(=O)NC2=O)C)O)COP(=O)(O)OP(=O)(O)OP(=O)(O)O

InChI

InChI=1S/C13H21N2O15P3/c1-3-8(16)13(6-27-32(23,24)30-33(25,26)29-31(20,21)22)9(17)4-10(28-13)15-5-7(2)11(18)14-12(15)19/h5,9-10,17H,3-4,6H2,1-2H3,(H,23,24)(H,25,26)(H,14,18,19)(H2,20,21,22)/t9-,10+,13-/m0/s1