In-Silico Structure Database (LMISSD)
Common Name
PA(P-16:1(11Z)/20:4(7E,10E,13E,16E))
Systematic Name
1-(1Z,11Z-hexadecadienyl)-2-(7E,10E,13E,16E-eicosatetraenoyl)-sn-glycero-3-phosphate
LM ID
LMGP10039ADY
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
678.462443
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphates [GP10]
1-(1Z-alkenyl),2-acylglycerophosphates [GP1003]
String Representations
InChiKey (Click to copy)
OYXCUPOQUHEXPJ-KCKNJMMXSA-N
InChi (Click to copy)
InChI=1S/C39H67O7P/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-26-28-30-32-34-39(40)46-38(37-45-47(41,42)43)36-44-35-33-31-29-27-25-23-18-16-14-12-10-8-6-4-2/h7,9-10,12-13,15,19-20,22,24,33,35,38H,3-6,8,11,14,16-18,21,23,25-32,34,36-37H2,1-2H3,(H2,41,42,43)/b9-7+,12-10-,15-13+,20-19+,24-22+,35-33-/t38-/m1/s1
SMILES (Click to copy)
[C@](COP(=O)(O)O)([H])(OC(CCCCC/C=C/C/C=C/C/C=C/C/C=C/CCC)=O)CO/C=C\CCCCCCCC/C=C\CCCC