In-Silico Structure Database (LMISSD)
Common Name
PGP(P-16:1(11Z)/26:2(5E,9Z))
Systematic Name
1-(1Z,11Z-hexadecadienyl)-2-(5Z,9E-hexacosadienoyl)-sn-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate)
LM ID
LMGP05039AEG
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
920.590756
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoglycerophosphates [GP05]
1-(1Z-alkenyl),2-acylglycerophosphoglycerophosphates [GP0503]
String Representations
InChiKey (Click to copy)
GZSODIZHTBTAIK-LCUXFBDQSA-N
InChi (Click to copy)
InChI=1S/C48H90O12P2/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-30-32-34-36-38-40-48(50)60-47(45-59-62(54,55)58-43-46(49)42-57-61(51,52)53)44-56-41-39-37-35-33-31-29-18-16-14-12-10-8-6-4-2/h10,12,26-27,32,34,39,41,46-47,49H,3-9,11,13-25,28-31,33,35-38,40,42-45H2,1-2H3,(H,54,55)(H2,51,52,53)/b12-10-,27-26-,34-32+,41-39-/t46-,47+/m0/s1
SMILES (Click to copy)
[C@]([H])(OC(CCC/C=C/CC/C=C\CCCCCCCCCCCCCCCC)=O)(COP(=O)(O)OC[C@@]([H])(O)COP(O)(O)=O)CO/C=C\CCCCCCCC/C=C\CCCC