[(3S,5R)-5-(4-azanyl-5-bromanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-oxolan-2-yl]methyl [(2R,3S,5R)-5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-2-(hydroxymethyl)oxolan-3-yl] hydrogen phosphate

Systemtic Name: [(3S,5R)-5-(4-azanyl-5-bromanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-oxolan-2-yl]methyl [(2R,3S,5R)-5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-2-(hydroxymethyl)oxolan-3-yl] hydrogen phosphate Openeye Name: [(3S,5R)-5-(4-amino-5-bromo-2-oxo-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl [(2R,3S,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-2-(hydroxymethyl)tetrahydrofuran-3-yl] hydrogen phosphate CAS Name: [(3S,5R)-5-(4-amino-5-bromo-2-oxo-1-pyrimidinyl)-3-hydroxy-2-oxolanyl]methyl [(2R,3S,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-2-(hydroxymethyl)-3-oxolanyl] hydrogen phosphate IUPAC Name: [(3S,5R)-5-(4-amino-5-bromo-2-oxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methyl [(2R,3S,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-2-(hydroxymethyl)oxolan-3-yl] hydrogen phosphate Traditional Name: [(3S,5R)-5-(4-amino-5-bromo-2-keto-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl [(2R,3S,5R)-5-(2-amino-6-keto-3H-purin-9-yl)-2-methylol-tetrahydrofuran-3-yl] hydrogen phosphate Formula: C19H24BrN8O10P MolecularWeight: 635.319221

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=C(C(=NC2=O)N)Br)COP(=O)(O)OC3CC(OC3CO)N4C=NC5=C4NC(=NC5=O)N)O

Isomeric SMILES

C1[C@@H]([C@H](O[C@H]1N2C=NC3=C2NC(=NC3=O)N)CO)OP(=O)(O)OCC4[C@H](C[C@@H](O4)N5C=C(C(=NC5=O)N)Br)O

InChI

InChI=1S/C19H24BrN8O10P/c20-7-3-27(19(32)24-15(7)21)12-1-8(30)11(37-12)5-35-39(33,34)38-9-2-13(36-10(9)4-29)28-6-23-14-16(28)25-18(22)26-17(14)31/h3,6,8-13,29-30H,1-2,4-5H2,(H,33,34)(H2,21,24,32)(H3,22,25,26,31)/t8-,9-,10+,11?,12+,13+/m0/s1