1-[(2R,3R,4S,5R)-5-[[[[[[[(2R,3S,4R,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphinothioyl]oxy-oxidanyl-phosphinothioyl]oxy-oxidanyl-phosphinothioyl]oxy-sulfanyl-phosphoryl]oxy-oxidanyl-phosphinothioyl]oxymethyl]-3,4-bis(oxidanyl)oxolan-2-yl]pyrimidine-2,4-dione

Systemtic Name: 1-[(2R,3R,4S,5R)-5-[[[[[[[(2R,3S,4R,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphinothioyl]oxy-oxidanyl-phosphinothioyl]oxy-oxidanyl-phosphinothioyl]oxy-sulfanyl-phosphoryl]oxy-oxidanyl-phosphinothioyl]oxymethyl]-3,4-bis(oxidanyl)oxolan-2-yl]pyrimidine-2,4-dione Openeye Name: 1-[(2R,3R,4S,5R)-5-[[[[[[[(2R,3S,4R,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphinothioyl]oxy-hydroxy-phosphinothioyl]oxy-hydroxy-phosphinothioyl]oxy-sulfanyl-phosphoryl]oxy-hydroxy-phosphinothioyl]oxymethyl]-3,4-dihydroxy-tetrahydrofuran-2-yl]pyrimidine-2,4-dione CAS Name: 1-[(2R,3R,4S,5R)-5-[[[[[[[(2R,3S,4R,5R)-5-(4-amino-2-oxo-1-pyrimidinyl)-3,4-dihydroxy-2-oxolanyl]methoxy-hydroxyphosphinothioyl]oxy-hydroxyphosphinothioyl]oxy-hydroxyphosphinothioyl]oxy-mercaptophosphoryl]oxy-hydroxyphosphinothioyl]oxymethyl]-3,4-dihydroxy-2-oxolanyl]pyrimidine-2,4-dione IUPAC Name: 1-[(2R,3R,4S,5R)-5-[[[[[[[(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-hydroxyphosphinothioyl]oxy-hydroxyphosphinothioyl]oxy-sulfanylphosphoryl]oxy-hydroxyphosphinothioyl]oxymethyl]-3,4-dihydroxyoxolan-2-yl]pyrimidine-2,4-dione Traditional Name: 1-[(2R,3R,4S,5R)-5-[[[[[[[(2R,3S,4R,5R)-5-(4-amino-2-keto-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-thiophosphoryl]oxy-hydroxy-thiophosphoryl]oxy-hydroxy-thiophosphoryl]oxy-mercapto-phosphoryl]oxy-hydroxy-thiophosphoryl]oxymethyl]-3,4-dihydroxy-tetrahydrofuran-2-yl]pyrimidine-2,4-quinone Formula: C18H28N5O20P5S5 MolecularWeight: 949.630225

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=O)N=C1N)C2C(C(C(O2)COP(=S)(O)OP(=S)(O)OP(=S)(O)OP(=O)(OP(=S)(O)OCC3C(C(C(O3)N4C=CC(=O)NC4=O)O)O)S)O)O

Isomeric SMILES

C1=CN(C(=O)N=C1N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=S)(O)OP(=S)(O)OP(=S)(O)OP(=O)(OP(=S)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=CC(=O)NC4=O)O)O)S)O)O

InChI

InChI=1S/C18H28N5O20P5S5/c19-9-1-3-22(17(29)20-9)15-13(27)11(25)7(38-15)5-36-44(31,49)40-46(33,51)42-48(35,53)43-47(34,52)41-45(32,50)37-6-8-12(26)14(28)16(39-8)23-4-2-10(24)21-18(23)30/h1-4,7-8,11-16,25-28H,5-6H2,(H,31,49)(H,32,50)(H,33,51)(H,34,52)(H,35,53)(H2,19,20,29)(H,21,24,30)/t7-,8-,11-,12-,13-,14-,15-,16-,44?,45?,46?,47?,48?/m1/s1