[5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-4,4-bis(fluoranyl)-3-oxidanyl-oxolan-2-yl]methyl [(2S)-3-octadecoxy-2-phenylmethoxy-propyl] hydrogen phosphate

Systemtic Name: [5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-4,4-bis(fluoranyl)-3-oxidanyl-oxolan-2-yl]methyl [(2S)-3-octadecoxy-2-phenylmethoxy-propyl] hydrogen phosphate Openeye Name: [5-(4-amino-2-oxo-pyrimidin-1-yl)-4,4-difluoro-3-hydroxy-tetrahydrofuran-2-yl]methyl [(2S)-2-benzyloxy-3-octadecoxy-propyl] hydrogen phosphate CAS Name: [5-(4-amino-2-oxo-1-pyrimidinyl)-4,4-difluoro-3-hydroxy-2-oxolanyl]methyl [(2S)-3-octadecoxy-2-phenylmethoxypropyl] hydrogen phosphate IUPAC Name: [5-(4-amino-2-oxopyrimidin-1-yl)-4,4-difluoro-3-hydroxyoxolan-2-yl]methyl [(2S)-3-octadecoxy-2-phenylmethoxypropyl] hydrogen phosphate Traditional Name: [5-(4-amino-2-keto-pyrimidin-1-yl)-4,4-difluoro-3-hydroxy-tetrahydrofuran-2-yl]methyl [(2S)-2-benzoxy-3-stearyloxy-propyl] hydrogen phosphate Formula: C37H60F2N3O9P MolecularWeight: 759.857567

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(COP(=O)(O)OCC1C(C(C(O1)N2C=CC(=NC2=O)N)(F)F)O)OCC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC[C@@H](COP(=O)(O)OCC1C(C(C(O1)N2C=CC(=NC2=O)N)(F)F)O)OCC3=CC=CC=C3

InChI

InChI=1S/C37H60F2N3O9P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-25-47-27-31(48-26-30-21-18-17-19-22-30)28-49-52(45,46)50-29-32-34(43)37(38,39)35(51-32)42-24-23-33(40)41-36(42)44/h17-19,21-24,31-32,34-35,43H,2-16,20,25-29H2,1H3,(H,45,46)(H2,40,41,44)/t31-,32?,34?,35?/m0/s1