[(2R)-3-[2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]ethoxy-oxidanyl-phosphoryl]oxy-2-oxidanyl-propyl] hexadecanoate

Systemtic Name: [(2R)-3-[2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]ethoxy-oxidanyl-phosphoryl]oxy-2-oxidanyl-propyl] hexadecanoate Openeye Name: [(2R)-3-[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethoxy-hydroxy-phosphoryl]oxy-2-hydroxy-propyl] hexadecanoate CAS Name: hexadecanoic acid [(2R)-3-[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethoxy-hydroxyphosphoryl]oxy-2-hydroxypropyl] ester IUPAC Name: [(2R)-3-[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethoxy-hydroxyphosphoryl]oxy-2-hydroxypropyl] hexadecanoate Traditional Name: palmitic acid [(2R)-3-[2-[(2-amino-6-keto-3H-purin-9-yl)methoxy]ethoxy-hydroxy-phosphoryl]oxy-2-hydroxy-propyl] ester Formula: C27H48N5O9P MolecularWeight: 617.671881

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCCOCN1C=NC2=C1NC(=NC2=O)N)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OCCOCN1C=NC2=C1NC(=NC2=O)N)O

InChI

InChI=1S/C27H48N5O9P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-23(34)39-18-22(33)19-41-42(36,37)40-17-16-38-21-32-20-29-24-25(32)30-27(28)31-26(24)35/h20,22,33H,2-19,21H2,1H3,(H,36,37)(H3,28,30,31,35)/t22-/m1/s1