[[(1S,2S,3S,5S)-3-azido-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-2-bicyclo[3.1.0]hexanyl]methoxy-oxidanyl-phosphoryl] phosphono hydrogen phosphate

Systemtic Name: [[(1S,2S,3S,5S)-3-azido-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-2-bicyclo[3.1.0]hexanyl]methoxy-oxidanyl-phosphoryl] phosphono hydrogen phosphate Openeye Name: [[(1S,2S,3S,5S)-3-azido-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)-2-bicyclo[3.1.0]hexanyl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate CAS Name: [[(1S,2S,3S,5S)-3-azido-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2-bicyclo[3.1.0]hexanyl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate IUPAC Name: [[(1S,2S,3S,5S)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-2-bicyclo[3.1.0]hexanyl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate Traditional Name: [[(1S,2S,3S,5S)-3-azido-5-(2,4-diketo-5-methyl-pyrimidin-1-yl)-2-bicyclo[3.1.0]hexanyl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate Formula: C12H18N5O12P3 MolecularWeight: 517.218903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C23CC2C(C(C3)N=[N+]=[N-])COP(=O)(O)OP(=O)(O)OP(=O)(O)O

Isomeric SMILES

CC1=CN(C(=O)NC1=O)[C@]23C[C@H]2[C@@H]([C@H](C3)N=[N+]=[N-])COP(=O)(O)OP(=O)(O)OP(=O)(O)O

InChI

InChI=1S/C12H18N5O12P3/c1-6-4-17(11(19)14-10(6)18)12-2-8(12)7(9(3-12)15-16-13)5-27-31(23,24)29-32(25,26)28-30(20,21)22/h4,7-9H,2-3,5H2,1H3,(H,23,24)(H,25,26)(H,14,18,19)(H2,20,21,22)/t7-,8-,9-,12-/m0/s1