In-Silico Structure Database (LMISSD)
Common Name
PG(O-14:0/16:1(7Z))
Systematic Name
1-tetradecyl-2-(7Z-hexadecenoyl)-sn-glycero-3-phospho-(1'-sn-glycerol)
LM ID
LMGP04029AAJ
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
678.483573
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoglycerols [GP04]
1-alkyl,2-acylglycerophosphoglycerols [GP0402]
String Representations
InChiKey (Click to copy)
CQXOUHVXNJHRHT-WWUCIAQXSA-N
InChi (Click to copy)
InChI=1S/C36H71O9P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-36(39)45-35(33-44-46(40,41)43-31-34(38)30-37)32-42-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h17-18,34-35,37-38H,3-16,19-33H2,1-2H3,(H,40,41)/b18-17-/t34-,35+/m0/s1
SMILES (Click to copy)
[C@]([H])(OC(CCCCC/C=C\CCCCCCCC)=O)(COP(=O)(O)OC[C@@]([H])(O)CO)COCCCCCCCCCCCCCC