(2S,3R)-2-azanyl-3-[3-octadecanoyloxypropoxy(oxidanyl)phosphoryl]oxy-butanoic acid

Systemtic Name: (2S,3R)-2-azanyl-3-[3-octadecanoyloxypropoxy(oxidanyl)phosphoryl]oxy-butanoic acid Openeye Name: (2S,3R)-2-amino-3-[hydroxy(3-octadecanoyloxypropoxy)phosphoryl]oxy-butanoic acid CAS Name: (2S,3R)-2-amino-3-[hydroxy-[3-(1-oxooctadecoxy)propoxy]phosphoryl]oxybutanoic acid IUPAC Name: (2S,3R)-2-amino-3-[hydroxy(3-octadecanoyloxypropoxy)phosphoryl]oxybutanoic acid Traditional Name: (2S,3R)-2-amino-3-[hydroxy(3-stearoyloxypropoxy)phosphoryl]oxy-butyric acid Formula: C25H50NO8P MolecularWeight: 523.640161

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCCCOP(=O)(O)OC(C)C(C(=O)O)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCCCOP(=O)(O)O[C@H](C)[C@@H](C(=O)O)N

InChI

InChI=1S/C25H50NO8P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-23(27)32-20-18-21-33-35(30,31)34-22(2)24(26)25(28)29/h22,24H,3-21,26H2,1-2H3,(H,28,29)(H,30,31)/t22-,24+/m1/s1