bis[(2R,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)oxolan-2-yl] hydrogen phosphate

Systemtic Name: bis[(2R,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)oxolan-2-yl] hydrogen phosphate Openeye Name: bis[(2R,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)tetrahydrofuran-2-yl] hydrogen phosphate CAS Name: bis[(2R,5R)-5-(4-amino-2-oxo-1-pyrimidinyl)-2-oxolanyl] hydrogen phosphate IUPAC Name: bis[(2R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl] hydrogen phosphate Traditional Name: bis[(2R,5R)-5-(4-amino-2-keto-pyrimidin-1-yl)tetrahydrofuran-2-yl] hydrogen phosphate Formula: C16H21N6O8P MolecularWeight: 456.347101

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1N2C=CC(=NC2=O)N)OP(=O)(O)OC3CCC(O3)N4C=CC(=NC4=O)N

Isomeric SMILES

C1C[C@H](O[C@H]1N2C=CC(=NC2=O)N)OP(=O)(O)O[C@@H]3CC[C@@H](O3)N4C=CC(=NC4=O)N

InChI

InChI=1S/C16H21N6O8P/c17-9-5-7-21(15(23)19-9)11-1-3-13(27-11)29-31(25,26)30-14-4-2-12(28-14)22-8-6-10(18)20-16(22)24/h5-8,11-14H,1-4H2,(H,25,26)(H2,17,19,23)(H2,18,20,24)/t11-,12-,13-,14-/m1/s1