In-Silico Structure Database (LMISSD)
Common Name
PG(10:0/20:4(7E,10E,13E,16E))
Systematic Name
1-decanoyl-2-(7E,10E,13E,16E-eicosatetraenoyl)-sn-glycero-3-phospho-(1'-sn-glycerol)
LM ID
LMGP04019ABN
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
686.415888
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoglycerols [GP04]
Diacylglycerophosphoglycerols [GP0401]
String Representations
InChiKey (Click to copy)
UMKYOKCAAAIEIB-KTIHDUPRSA-N
InChi (Click to copy)
InChI=1S/C36H63O10P/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-22-24-26-28-36(40)46-34(32-45-47(41,42)44-30-33(38)29-37)31-43-35(39)27-25-23-21-10-8-6-4-2/h7,9,12-13,15-16,18-19,33-34,37-38H,3-6,8,10-11,14,17,20-32H2,1-2H3,(H,41,42)/b9-7+,13-12+,16-15+,19-18+/t33-,34+/m0/s1
SMILES (Click to copy)
[H][C@](O)(CO)COP(OC[C@]([H])(OC(CCCCC/C=C/C/C=C/C/C=C/C/C=C/CCC)=O)COC(CCCCCCCCC)=O)(=O)O