In-Silico Structure Database (LMISSD)
Common Name
LPE(18:2(9E,11E)/0:0)
Systematic Name
1-(9E,11E-octadecadienoyl)-sn-glycero-3-phosphoethanolamine
LM ID
LMGP02059AA0
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
477.285542
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoethanolamines [GP02]
Monoacylglycerophosphoethanolamines [GP0205]
String Representations
InChiKey (Click to copy)
KJUILYKMYXDSNE-WZCBVYJRSA-N
InChi (Click to copy)
InChI=1S/C23H44NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(26)29-20-22(25)21-31-32(27,28)30-19-18-24/h7-10,22,25H,2-6,11-21,24H2,1H3,(H,27,28)/b8-7+,10-9+/t22-/m1/s1
SMILES (Click to copy)
[C@](COP(=O)(O)OCCN)([H])(O)COC(CCCCCCC/C=C/C=C/CCCCCC)=O