88542-97-6
1-(CIS-9-OCTADECEN-1-YL)-2-LINOLEOYL-SN-GLYCERO-3-PHOSPHORYLCHOLINE
Name1-(CIS-9-OCTADECEN-1-YL)-2-LINOLEOYL-SN-GLYCERO-3-PHOSPHORYLCHOLINE
1Identification
【Name】
1-(CIS-9-OCTADECEN-1-YL)-2-LINOLEOYL-SN-GLYCERO-3-PHOSPHORYLCHOLINE
【CAS】
【MDL】
MFCD11974152
【English Synonyms】
【Formula】
C44 H84 N O7 P
【MolWeight】
770.122
【Inchi】
InChI=1S/C44H84NO7P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-39-49-41-43(42-51-53(47,48)50-40-38-45(3,4)5)52-44(46)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h15,17,20-23,43H,6-14,16,18-19,24-42H2,1-5H3/b17-15-,22-20-,23-21-/t43-/m1/s1
【InChIKey】
InChIKey=MFZLAZYUXHHSIA-HVODBARTSA-N
【SMILES】
CCCCCCCC/C=C\CCCCCCCCOC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC
【MOL File】
1-(CIS-9-OCTADECEN-1….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:8
XLogP3:13.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(CIS-9-OCTADECEN-1-YL)-2-LINOLEOYL-SN-GLYCERO-3-PHOSPHORYLCHOLINE.cml