1-Oleoyl-2-docosahexaenoyl phosphatidylcholine

[(2R)-2-[(4E,7Z,10E,13E,16E,19E)-docosa-4,7,10,13,16,19-hexaenoyl]oxy-3-[(E)-octadec-9-enoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate

Also Known As: 1-Odhpc|1-Oleoyl-2-dha-PC|1-Oleoyl-2-docosahexaenoyl phosphatidylcholine|2-Docosahexaenoin-1-oleoyl 3-Phosphocholine|1-Oleoyl-2-docosahexaenoylglycero-3-phosphorylcholine|1-Oleoyl-2-docosahexaenoyl-sn-glycero-3-phosphocholine|[(2R)-2-[(4E,7Z,10E,13E,16E,19E)-docosa-4,7,10,13,16,19-hexaenoyl]oxy-3-[(E)-octadec-9-enoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate|[R-(all-Z)]-4-Hydroxy-N,N,N-trimethyl-9-oxo-7-[[[(9Z)-1-oxo-9-
octadecen-1-yl]oxy]methyl]-3,5,8-trioxa-4-phosphatriaconta-12,15,18,21,24,27-hexaen-1-aminium Inner Salt 4-Oxide|3,5,8-Trioxa-4-phosphatriaconta-12,15,18,21,24,27-hexaen-1-aminium, 4-hydroxy-N,N,N-trimethyl-9-oxo-7-(((1-oxo-9-octadecenyl)oxy)methyl)-, hydroxide, inner salt, 4-oxide, (R-(all-Z))-

Molecular Formula	C48H82NO8P
Molecular Weight	831.5778 g/mol
LogP	12.1646
Topological Polar Surface Area	111.19 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	8
Rotatable Bonds	39
Exact Mass	831.5778
Monoisotopic Mass	831.5778
Heavy Atoms	58
Complexity	1260.4877

Chemical Identifiers

CAS Number	99296-82-9
SMILES	CCCCCCCC/C=C/CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CC/C=C/C/C=C\C/C=C/C/C=C/C/C=C/C/C=C/CC