In-Silico Structure Database (LMISSD)
Common Name
PGP(11:0/20:3(5Z,8Z,11Z))
Systematic Name
1-undecanoyl-2-(5Z,8Z,11Z-eicosatrienoyl)-sn-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate)
LM ID
LMGP05019ADR
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
782.413521
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoglycerophosphates [GP05]
Diacylglycerophosphoglycerophosphates [GP0501]
String Representations
InChiKey (Click to copy)
UUQDYFVJTQBFHF-BPAAXWEFSA-N
InChi (Click to copy)
InChI=1S/C37H68O13P2/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-23-25-27-29-37(40)50-35(32-46-36(39)28-26-24-22-12-10-8-6-4-2)33-49-52(44,45)48-31-34(38)30-47-51(41,42)43/h15-16,18-19,21,23,34-35,38H,3-14,17,20,22,24-33H2,1-2H3,(H,44,45)(H2,41,42,43)/b16-15-,19-18-,23-21-/t34-,35+/m0/s1
SMILES (Click to copy)
[H][C@](O)(COP(O)(O)=O)COP(OC[C@]([H])(OC(CCC/C=C\C/C=C\C/C=C\CCCCCCCC)=O)COC(CCCCCCCCCC)=O)(=O)O