In-Silico Structure Database (LMISSD)
Common Name
PE(P-22:1(9Z)/38:0)
Systematic Name
1-(1Z,9Z-docosenyl)-2-octatriacontanoyl-sn-glycero-3-phosphoethanolamine
LM ID
LMGP02039A1W
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
1065.942842
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoethanolamines [GP02]
1-(1Z-alkenyl),2-acylglycerophosphoethanolamines [GP0203]
String Representations
InChiKey (Click to copy)
DNAOJZCYFRRJRP-CTGXAANASA-N
InChi (Click to copy)
InChI=1S/C65H128NO7P/c1-3-5-7-9-11-13-15-17-19-21-23-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39-40-42-44-46-48-50-52-54-56-58-65(67)73-64(63-72-74(68,69)71-61-59-66)62-70-60-57-55-53-51-49-47-45-43-41-24-22-20-18-16-14-12-10-8-6-4-2/h41,43,57,60,64H,3-40,42,44-56,58-59,61-63,66H2,1-2H3,(H,68,69)/b43-41-,60-57-/t64-/m1/s1
SMILES (Click to copy)
[C@](COP(=O)(O)OCCN)([H])(OC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)CO/C=C\CCCCCC/C=C\CCCCCCCCCCCC