In-Silico Structure Database (LMISSD)
Common Name
PC(O-14:0/20:1(13E))
Systematic Name
1-tetradecyl-2-(13E-eicosenoyl)-sn-glycero-3-phosphocholine
LM ID
LMGP01029ABC
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
745.598542
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphocholines [GP01]
1-alkyl,2-acylglycerophosphocholines [GP0102]
String Representations
InChiKey (Click to copy)
LIDLFNOJQZBHJC-NHNRRHIVSA-N
InChi (Click to copy)
InChI=1S/C42H84NO7P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-27-29-31-33-35-42(44)50-41(40-49-51(45,46)48-38-36-43(3,4)5)39-47-37-34-32-30-28-26-19-17-15-13-11-9-7-2/h16,18,41H,6-15,17,19-40H2,1-5H3/b18-16+/t41-/m1/s1
SMILES (Click to copy)
[C@](COP(=O)([O-])OCC[N+](C)(C)C)([H])(OC(CCCCCCCCCCC/C=C/CCCCCC)=O)COCCCCCCCCCCCCCC