2-azaniumylethyl [3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxy-2-oxidanyl-propyl] phosphate

Systemtic Name: 2-azaniumylethyl [3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxy-2-oxidanyl-propyl] phosphate Openeye Name: 2-azaniumylethyl [2-hydroxy-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxy-propyl] phosphate CAS Name: 2-ammonioethyl [2-hydroxy-3-[(9Z,12Z,15Z)-1-oxooctadeca-9,12,15-trienoxy]propyl] phosphate IUPAC Name: 2-azaniumylethyl [2-hydroxy-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxypropyl] phosphate Traditional Name: 2-ammonioethyl [2-hydroxy-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxy-propyl] phosphate Formula: C23H42NO7P MolecularWeight: 475.555841

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CCC=CCC=CCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[NH3+])O

Isomeric SMILES

CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OCC(COP(=O)([O-])OCC[NH3+])O

InChI

InChI=1S/C23H42NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(26)29-20-22(25)21-31-32(27,28)30-19-18-24/h3-4,6-7,9-10,22,25H,2,5,8,11-21,24H2,1H3,(H,27,28)/b4-3-,7-6-,10-9-