[3-[[[(2S,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxy-oxidanyl-phosphoryl]oxy-2-tetradecanoyloxy-propyl] tetradecanoate

Systemtic Name: [3-[[[(2S,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxy-oxidanyl-phosphoryl]oxy-2-tetradecanoyloxy-propyl] tetradecanoate Openeye Name: [3-[[[(2S,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-2-tetradecanoyloxy-propyl] tetradecanoate CAS Name: tetradecanoic acid [3-[[[(2S,5R)-5-(4-amino-2-oxo-1-pyrimidinyl)-2-oxolanyl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-(1-oxotetradecoxy)propyl] ester IUPAC Name: [3-[[[(2S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-tetradecanoyloxypropyl] tetradecanoate Traditional Name: myristic acid [3-[[[(2S,5R)-5-(4-amino-2-keto-pyrimidin-1-yl)tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-2-tetradecanoyloxy-propyl] ester Formula: C40H73N3O13P2 MolecularWeight: 865.967442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OP(=O)(O)OCC1CCC(O1)N2C=CC(=NC2=O)N)OC(=O)CCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OP(=O)(O)OC[C@@H]1CC[C@@H](O1)N2C=CC(=NC2=O)N)OC(=O)CCCCCCCCCCCCC

InChI

InChI=1S/C40H73N3O13P2/c1-3-5-7-9-11-13-15-17-19-21-23-25-38(44)51-31-35(55-39(45)26-24-22-20-18-16-14-12-10-8-6-4-2)33-53-58(49,50)56-57(47,48)52-32-34-27-28-37(54-34)43-30-29-36(41)42-40(43)46/h29-30,34-35,37H,3-28,31-33H2,1-2H3,(H,47,48)(H,49,50)(H2,41,42,46)/t34-,35?,37+/m0/s1