In-Silico Structure Database (LMISSD)
Common Name
PG(10:0/20:4(5E,8E,11E,14E))
Systematic Name
1-decanoyl-2-(5E,8E,11E,14E-eicosatetraenoyl)-sn-glycero-3-phospho-(1'-sn-glycerol)
LM ID
LMGP04019ABI
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
686.415888
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoglycerols [GP04]
Diacylglycerophosphoglycerols [GP0401]
String Representations
InChiKey (Click to copy)
WYJLJKRLLNBSSQ-KFUNKQSYSA-N
InChi (Click to copy)
InChI=1S/C36H63O10P/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-22-24-26-28-36(40)46-34(32-45-47(41,42)44-30-33(38)29-37)31-43-35(39)27-25-23-21-10-8-6-4-2/h11-12,14-15,17-18,20,22,33-34,37-38H,3-10,13,16,19,21,23-32H2,1-2H3,(H,41,42)/b12-11+,15-14+,18-17+,22-20+/t33-,34+/m0/s1
SMILES (Click to copy)
[H][C@](O)(CO)COP(OC[C@]([H])(OC(CCC/C=C/C/C=C/C/C=C/C/C=C/CCCCC)=O)COC(CCCCCCCCC)=O)(=O)O