In-Silico Structure Database (LMISSD)
Common Name
PC(O-14:0/20:4(7E,10E,13E,16E))
Systematic Name
1-tetradecyl-2-(7E,10E,13E,16E-eicosatetraenoyl)-sn-glycero-3-phosphocholine
LM ID
LMGP01029ABN
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
739.551592
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphocholines [GP01]
1-alkyl,2-acylglycerophosphocholines [GP0102]
String Representations
InChiKey (Click to copy)
LTVSNZODYDHTKY-BEAWIEPASA-N
InChi (Click to copy)
InChI=1S/C42H78NO7P/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/h10,12,16,18,21-22,24-25,41H,6-9,11,13-15,17,19-20,23,26-40H2,1-5H3/b12-10+,18-16+,22-21+,25-24+/t41-/m1/s1
SMILES (Click to copy)
[C@](COP(=O)([O-])OCC[N+](C)(C)C)([H])(OC(CCCCC/C=C/C/C=C/C/C=C/C/C=C/CCC)=O)COCCCCCCCCCCCCCC