[5-[1-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-2,4-bis(oxidanylidene)pyrimidin-5-yl]thiophen-2-yl] [oxidanyl(phosphonooxy)phosphoryl] hydrogen phosphate

Systemtic Name: [5-[1-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-2,4-bis(oxidanylidene)pyrimidin-5-yl]thiophen-2-yl] [oxidanyl(phosphonooxy)phosphoryl] hydrogen phosphate Openeye Name: [hydroxy-[[5-[1-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2,4-dioxo-pyrimidin-5-yl]-2-thienyl]oxy]phosphoryl] phosphono hydrogen phosphate CAS Name: [hydroxy-[[5-[1-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-2,4-dioxo-5-pyrimidinyl]-2-thiophenyl]oxy]phosphoryl] phosphono hydrogen phosphate IUPAC Name: [hydroxy-[5-[1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2,4-dioxopyrimidin-5-yl]thiophen-2-yl]oxyphosphoryl] phosphono hydrogen phosphate Traditional Name: [hydroxy-[[5-[1-(4-hydroxy-5-methylol-tetrahydrofuran-2-yl)-2,4-diketo-pyrimidin-5-yl]-2-thienyl]oxy]phosphoryl] phosphono hydrogen phosphate Formula: C13H17N2O15P3S MolecularWeight: 566.264763

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=C(C(=O)NC2=O)C3=CC=C(S3)OP(=O)(O)OP(=O)(O)OP(=O)(O)O)CO)O

Isomeric SMILES

C1C(C(OC1N2C=C(C(=O)NC2=O)C3=CC=C(S3)OP(=O)(O)OP(=O)(O)OP(=O)(O)O)CO)O

InChI

InChI=1S/C13H17N2O15P3S/c16-5-8-7(17)3-10(27-8)15-4-6(12(18)14-13(15)19)9-1-2-11(34-9)28-32(23,24)30-33(25,26)29-31(20,21)22/h1-2,4,7-8,10,16-17H,3,5H2,(H,23,24)(H,25,26)(H,14,18,19)(H2,20,21,22)