In-Silico Structure Database (LMISSD)
Common Name
PG(O-18:1(11Z)/16:1(7Z))
Systematic Name
1-(11Z-octadecenyl)-2-(7Z-hexadecenoyl)-sn-glycero-3-phospho-(1'-sn-glycerol)
LM ID
LMGP04029AOD
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-alkyl,2-acylglycerophosphoglycerols [GP0402]
String Representations
InChiKey (Click to copy)
PJRMNHHJLBKDJR-DJXMVVQGSA-N
InChi (Click to copy)
InChI=1S/C40H77O9P/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-31-33-46-36-39(37-48-50(44,45)47-35-38(42)34-41)49-40(43)32-30-28-26-24-22-20-16-14-12-10-8-6-4-2/h13,15,20,22,38-39,41-42H,3-12,14,16-19,21,23-37H2,1-2H3,(H,44,45)/b15-13-,22-20-/t38-,39+/m0/s1
SMILES (Click to copy)
[C@]([H])(OC(CCCCC/C=C\CCCCCCCC)=O)(COP(=O)(O)OC[C@@]([H])(O)CO)COCCCCCCCCCC/C=C\CCCCCC