In-Silico Structure Database (LMISSD)
Common Name
PA(10:0/8:1(6E)(5Ke,8Ke))
Systematic Name
1-decanoyl-2-(5,8-dioxo-6E-octenoyl)-sn-glycero-3-phosphate
LM ID
LMGP20079ABZ
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
478.196788
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Oxidized glycerophospholipids [GP20]
Oxidized glycerophosphates [GP2007]
String Representations
InChiKey (Click to copy)
ACVZGQVCQQRJOF-FMAYLGMYSA-N
InChi (Click to copy)
InChI=1S/C21H35O10P/c1-2-3-4-5-6-7-8-13-20(24)29-16-19(17-30-32(26,27)28)31-21(25)14-9-11-18(23)12-10-15-22/h10,12,15,19H,2-9,11,13-14,16-17H2,1H3,(H2,26,27,28)/b12-10+/t19-/m1/s1
SMILES (Click to copy)
[C@](COP(=O)(O)O)([H])(OC(CCCC(=O)/C=C/C=O)=O)COC(CCCCCCCCC)=O