In-Silico Structure Database (LMISSD)
Common Name
PG(P-14:0/20:1(11E))
Systematic Name
1-(1Z-tetradecenyl)-2-(11E-eicosenoyl)-sn-glycero-3-phospho-(1'-sn-glycerol)
LM ID
LMGP04039DEF
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
732.530523
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoglycerols [GP04]
1-(1Z-alkenyl),2-acylglycerophosphoglycerols [GP0403]
String Representations
InChiKey (Click to copy)
PNKMERFRUMUPGL-ABLMKNNUSA-N
InChi (Click to copy)
InChI=1S/C40H77O9P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-40(43)49-39(37-48-50(44,45)47-35-38(42)34-41)36-46-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h17-18,31,33,38-39,41-42H,3-16,19-30,32,34-37H2,1-2H3,(H,44,45)/b18-17+,33-31-/t38-,39+/m0/s1
SMILES (Click to copy)
[C@]([H])(OC(CCCCCCCCC/C=C/CCCCCCCC)=O)(COP(=O)(O)OC[C@@]([H])(O)CO)CO/C=C\CCCCCCCCCCCC