In-Silico Structure Database (LMISSD)
Common Name
PA(O-16:1(11Z)/37:0)
Systematic Name
1-(11Z-hexadecenyl)-2-heptatriacontanoyl-sn-glycero-3-phosphate
LM ID
LMGP10029AJF
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
926.806743
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphates [GP10]
1-alkyl,2-acylglycerophosphates [GP1002]
String Representations
InChiKey (Click to copy)
KKWRASQSMCVWEG-WNKPKXSBSA-N
InChi (Click to copy)
InChI=1S/C56H111O7P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39-41-43-45-47-49-51-56(57)63-55(54-62-64(58,59)60)53-61-52-50-48-46-44-42-40-18-16-14-12-10-8-6-4-2/h10,12,55H,3-9,11,13-54H2,1-2H3,(H2,58,59,60)/b12-10-/t55-/m1/s1
SMILES (Click to copy)
[C@](COP(=O)(O)O)([H])(OC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)COCCCCCCCCCC/C=C\CCCC