In-Silico Structure Database (LMISSD)
Common Name
PG(10:0/18:3(6Z,9Z,12Z))
Systematic Name
1-decanoyl-2-(6Z,9Z,12Z-octadecatrienoyl)-sn-glycero-3-phospho-(1'-sn-glycerol)
LM ID
LMGP04019AA4
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
660.400238
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoglycerols [GP04]
Diacylglycerophosphoglycerols [GP0401]
String Representations
InChiKey (Click to copy)
YDSVKDGGSISKPT-SHXBWUCRSA-N
InChi (Click to copy)
InChI=1S/C34H61O10P/c1-3-5-7-9-11-12-13-14-15-16-17-18-20-22-24-26-34(38)44-32(30-43-45(39,40)42-28-31(36)27-35)29-41-33(37)25-23-21-19-10-8-6-4-2/h11-12,14-15,17-18,31-32,35-36H,3-10,13,16,19-30H2,1-2H3,(H,39,40)/b12-11-,15-14-,18-17-/t31-,32+/m0/s1
SMILES (Click to copy)
[H][C@](O)(CO)COP(OC[C@]([H])(OC(CCCC/C=C\C/C=C\C/C=C\CCCCC)=O)COC(CCCCCCCCC)=O)(=O)O