In-Silico Structure Database (LMISSD)
Common Name
PA(O-16:1(11Z)/38:0)
Systematic Name
1-(11Z-hexadecenyl)-2-octatriacontanoyl-sn-glycero-3-phosphate
LM ID
LMGP10029AJG
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
940.822393
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphates [GP10]
1-alkyl,2-acylglycerophosphates [GP1002]
String Representations
InChiKey (Click to copy)
BVILVSQXILEIAH-CFUFOLKGSA-N
InChi (Click to copy)
InChI=1S/C57H113O7P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39-40-42-44-46-48-50-52-57(58)64-56(55-63-65(59,60)61)54-62-53-51-49-47-45-43-41-18-16-14-12-10-8-6-4-2/h10,12,56H,3-9,11,13-55H2,1-2H3,(H2,59,60,61)/b12-10-/t56-/m1/s1
SMILES (Click to copy)
[C@](COP(=O)(O)O)([H])(OC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)COCCCCCCCCCC/C=C\CCCC