azanium [(2S)-2-azanyl-3-oxidanyl-3-oxidanylidene-propyl] [(2R)-3-heptadecanoyloxy-2-[(Z)-tetradec-9-enoyl]oxy-propyl] phosphate

Systemtic Name: azanium [(2S)-2-azanyl-3-oxidanyl-3-oxidanylidene-propyl] [(2R)-3-heptadecanoyloxy-2-[(Z)-tetradec-9-enoyl]oxy-propyl] phosphate Openeye Name: ammonium [(2S)-2-amino-3-hydroxy-3-oxo-propyl] [(2R)-3-heptadecanoyloxy-2-[(Z)-tetradec-9-enoyl]oxy-propyl] phosphate CAS Name: ammonium [(2S)-2-amino-3-hydroxy-3-oxopropyl] [(2R)-3-(1-oxoheptadecoxy)-2-[(Z)-1-oxotetradec-9-enoxy]propyl] phosphate IUPAC Name: azanium [(2S)-2-amino-3-hydroxy-3-oxopropyl] [(2R)-3-heptadecanoyloxy-2-[(Z)-tetradec-9-enoyl]oxypropyl] phosphate Traditional Name: ammonium [(2S)-2-amino-3-hydroxy-3-keto-propyl] [(2R)-3-heptadecanoyloxy-2-[(Z)-tetradec-9-enoyl]oxy-propyl] phosphate Formula: C37H73N2O10P MolecularWeight: 736.956681

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC(C(=O)O)N)OC(=O)CCCCCCCC=CCCCC.[NH4+]

Isomeric SMILES

CCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@@H](C(=O)O)N)OC(=O)CCCCCCC/C=C\CCCC.[NH4+]

InChI

InChI=1S/C37H70NO10P.H3N/c1-3-5-7-9-11-13-15-16-17-19-20-22-24-26-28-35(39)45-30-33(31-46-49(43,44)47-32-34(38)37(41)42)48-36(40)29-27-25-23-21-18-14-12-10-8-6-4-2;/h10,12,33-34H,3-9,11,13-32,38H2,1-2H3,(H,41,42)(H,43,44);1H3/b12-10-;/t33-,34+;/m1./s1