70094-88-1
3-PALMITOYL-2-LINOLEOYL-SN-GLYCERO-1-PHOSPHORYLCHOLINE
Name3-PALMITOYL-2-LINOLEOYL-SN-GLYCERO-1-PHOSPHORYLCHOLINE
1Identification
【Name】
3-PALMITOYL-2-LINOLEOYL-SN-GLYCERO-1-PHOSPHORYLCHOLINE
【CAS】
【MDL】
MFCD11974138
【English Synonyms】
【Formula】
C42 H80 N O8 P
【MolWeight】
758.067
【Inchi】
InChI=1S/C42H80NO8P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-42(45)51-40(39-50-52(46,47)49-37-36-43(3,4)5)38-48-41(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h14,16,20-21,40H,6-13,15,17-19,22-39H2,1-5H3/b16-14-,21-20-/t40-/m0/s1
【InChIKey】
InChIKey=JLPULHDHAOZNQI-GFEYFTFASA-N
【SMILES】
CCCCCCCCCCCCCCCC(=O)OC[C@@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC
【MOL File】
3-PALMITOYL-2-LINOLE….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:9
XLogP3:12.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-PALMITOYL-2-LINOLEOYL-SN-GLYCERO-1-PHOSPHORYLCHOLINE.cml