In-Silico Structure Database (LMISSD)
Common Name
PA(P-20:1(9Z)/28:0)
Systematic Name
1-(1Z,9Z-eicosadienyl)-2-octacosanoyl-sn-glycero-3-phosphate
LM ID
LMGP10039AUP
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
854.712843
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphates [GP10]
1-(1Z-alkenyl),2-acylglycerophosphates [GP1003]
String Representations
InChiKey (Click to copy)
QVVJAHXSALXTAS-JNQFADHHSA-N
InChi (Click to copy)
InChI=1S/C51H99O7P/c1-3-5-7-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-46-51(52)58-50(49-57-59(53,54)55)48-56-47-45-43-41-39-37-35-33-31-22-20-18-16-14-12-10-8-6-4-2/h22,31,45,47,50H,3-21,23-30,32-44,46,48-49H2,1-2H3,(H2,53,54,55)/b31-22-,47-45-/t50-/m1/s1
SMILES (Click to copy)
[C@](COP(=O)(O)O)([H])(OC(CCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)CO/C=C\CCCCCC/C=C\CCCCCCCCCC