In-Silico Structure Database (LMISSD)

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LMISSD: Lipid Classification search results

Glycerophospholipids [GP](W)  --> Oxidized glycerophospholipids [GP20] --> Oxidized glycerophosphoethanolamines [GP2002]

LM_ID Common Name Systematic Name Formula Mass
LMISGP20029BQZ PE(18:2(9E,12E)/8:1(6E)(5Ke,8Ke)) 1-(9E,12E-octadecadienoyl)-2-(5,8-dioxo-6E-octenoyl)-sn-glycero-3-phosphoethanolamine C31H52NO10P 629.3329
LMISGP20029BQ0 PE(18:2(9E,12E)/8:1(6E)(5Ke,8OH,8Ke)) 1-(9E,12E-octadecadienoyl)-2-(5-keto-7-carboxy-6E-heptenoyl)-sn-glycero-3-phosphoethanolamine C31H52NO11P 645.3278
LMISGP20029BQ1 PE(18:2(9E,12E)/8:1(6E)(5OH,8Ke)) 1-(9E,12E-octadecadienoyl)-2-(5-hydroxy-8-oxo-6E-octenoyl)-sn-glycero-3-phosphoethanolamine C31H54NO10P 631.3485
LMISGP20029BQ2 PE(18:2(9E,12E)/8:1(6E)(5OH,8OH,8Ke)) 1-(9E,12E-octadecadienoyl)-2-(5-hydroxy-7-carboxy-6E-heptenoyl)-sn-glycero-3-phosphoethanolamine C31H54NO11P 647.3435
LMISGP20029BQ3 PE(18:2(9E,12E)/9:0(9Ke)) 1-(9E,12E-octadecadienoyl)-2-(9-oxo-nonanoyl)-sn-glycero-3-phosphoethanolamine C32H58NO9P 631.3849
LMISGP20029BQ4 PE(18:2(9E,12E)/9:0(9OH,9Ke)) 1-(9E,12E-octadecadienoyl)-2-azeloyl-sn-glycero-3-phosphoethanolamine C32H58NO10P 647.3798
LMISGP20029BQ5 PE(18:2(9E,12E)/9:2(5E,7E)(4Ke,9Ke)) 1-(9E,12E-octadecadienoyl)-2-(4,9-dioxo-5E,7E-nonadienoyl)-sn-glycero-3-phosphoethanolamine C32H52NO10P 641.3329
LMISGP20029BPA PE(18:2(9E,12E)/11:1(9E)(11Ke)) 1-(9E,12E-octadecadienoyl)-2-(11-Oxo-9E-undecenoyl)-sn-glycero-3-phosphoethanolamine C34H60NO9P 657.4006
LMISGP20029BPB PE(18:2(9E,12E)/11:2(6E,8E)(5OH,10OH,11Ke)) 1-(9E,12E-octadecadienoyl)-2-(5,10-Dihydroxy-11-oxo-6E,8E-undecadienoyl)-sn-glycero-3-phosphoethanolamine C34H58NO11P 687.3748
LMISGP20029BPC PE(18:2(9E,12E)/12:0(9Ke,12Ke)) 1-(9E,12E-octadecadienoyl)-2-(9,12-dioxodecanoyl)-sn-glycero-3-phosphoethanolamine C35H62NO10P 687.4111
LMISGP20029BPD PE(18:2(9E,12E)/12:1(10E)(9Ke,12OH,12Ke)) 1-(9E,12E-octadecadienoyl)-2-(9-oxo-11-carboxy-10E-undecenoyl)-sn-glycero-3-phosphoethanolamine C35H60NO11P 701.3904
LMISGP20029BPE PE(18:2(9E,12E)/12:1(10E)(9OH,12Ke)) 1-(9E,12E-octadecadienoyl)-2-(9-hydroxy-12-oxo-10E-dodecenoyl)-sn-glycero-3-phosphoethanolamine C35H62NO10P 687.4111
LMISGP20029BPF PE(18:2(9E,12E)/12:1(10E)(9OH,12OH,12Ke)) 1-(9E,12E-octadecadienoyl)-2-(9-hydroxy-11-carboxy-10E-undecenoyl)-sn-glycero-3-phosphoethanolamine C35H62NO11P 703.4061
LMISGP20029BPG PE(18:2(9E,12E)/13:2(9E,11E)(13Ke)) 1-(9E,12E-octadecadienoyl)-2-(13-oxo-9E,11E-tridecedienoyl)-sn-glycero-3-phosphoethanolamine C36H62NO9P 683.4162
LMISGP20029BPH PE(18:2(9E,12E)/13:2(9E,11E)(8Ke,13Ke)) 1-(9E,12E-octadecadienoyl)-2-(8,13-dioxo-9E,11E-tridecadienoyl)-sn-glycero-3-phosphoethanolamine C36H60NO10P 697.3955
LMISGP20029BPI PE(18:2(9E,12E)/13:2(9E,11E)(8OH,13Ke)) 1-(9E,12E-octadecadienoyl)-2-(8-hydroxy-13-oxo-9E,11E-tridecadienoyl)-sn-glycero-3-phosphoethanolamine C36H62NO10P 699.4111
LMISGP20029BPJ PE(18:2(9E,12E)/13:3(5Z,8E,11E)(10OH,13Ke)) 1-(9E,12E-octadecadienoyl)-2-(10-hydroxy-13-oxo-5Z,8E,11E-tridecatrienoyl)-sn-glycero-3-phosphoethanolamine C36H60NO10P 697.3955
LMISGP20029BPK PE(18:2(9E,12E)/18:2(10E,12Z)(9OH[R])) 1-(9E,12E-octadecadienoyl)-2-(9R-HODE)-sn-glycero-3-phosphoethanolamine C41H74NO9P 755.5101
LMISGP20029BPL PE(18:2(9E,12E)/18:2(10E,12Z)(9OH[S])) 1-(9E,12E-octadecadienoyl)-2-(9S-HODE)-sn-glycero-3-phosphoethanolamine C41H74NO9P 755.5101
LMISGP20029BPM PE(18:2(9E,12E)/18:2(8E,12Z)(10OH[R])) 1-(9E,12E-octadecadienoyl)-2-(10R-HODE)-sn-glycero-3-phosphoethanolamine C41H74NO9P 755.5101
LMISGP20029BPN PE(18:2(9E,12E)/18:2(8E,12Z)(10OH[S])) 1-(9E,12E-octadecadienoyl)-2-(10S-HODE)-sn-glycero-3-phosphoethanolamine C41H74NO9P 755.5101
LMISGP20029BPO PE(18:2(9E,12E)/18:2(9Z,11E)(13OH[R])) 1-(9E,12E-octadecadienoyl)-2-(13R-HODE)-sn-glycero-3-phosphoethanolamine C41H74NO9P 755.5101
LMISGP20029BPP PE(18:2(9E,12E)/18:2(9Z,11E)(13OH[S])) 1-(9E,12E-octadecadienoyl)-2-(13S-HODE)-sn-glycero-3-phosphoethanolamine C41H74NO9P 755.5101
LMISGP20029BPQ PE(18:2(9E,12E)/18:2(9Z,12Z)(8OH[R])) 1-(9E,12E-octadecadienoyl)-2-(8R-HODE)-sn-glycero-3-phosphoethanolamine C41H74NO9P 755.5101
LMISGP20029BPR PE(18:2(9E,12E)/18:2(9Z,12Z)(8OH[S])) 1-(9E,12E-octadecadienoyl)-2-(8S-HODE)-sn-glycero-3-phosphoethanolamine C41H74NO9P 755.5101
LMISGP20029BPS PE(18:2(9E,12E)/18:2(9Z,15Z)(12OH[R])) 1-(9E,12E-octadecadienoyl)-2-(12R-HODE)-sn-glycero-3-phosphoethanolamine C41H74NO9P 755.5101
LMISGP20029BPT PE(18:2(9E,12E)/18:2(9Z,15Z)(12OH[S])) 1-(9E,12E-octadecadienoyl)-2-(12S-HODE)-sn-glycero-3-phosphoethanolamine C41H74NO9P 755.5101
LMISGP20029BPV PE(18:2(9E,12E)/20:2(5Z,13E)(11OH[R],9Ke,15OH[S]){8a,12b}) 1-(9E,12E-octadecadienoyl)-2-PGE2-sn-glycero-3-phosphoethanolamine C43H74NO11P 811.5000
LMISGP20029BPW PE(18:2(9E,12E)/20:2(5Z,13E)(9OH[S],11Ke,15OH[S]){8a,12b}) 1-(9E,12E-octadecadienoyl)-2-PGD2-sn-glycero-3-phosphoethanolamine C43H74NO11P 811.5000
LMISGP20029BPX PE(18:2(9E,12E)/20:2(7E,14Z)(5Ep,9Ke,11OH){8,12}) 1-(9E,12E-octadecadienoyl)-2-(5,6-epoxy-isoPE2)-sn-glycero-3-phosphoethanolamine C43H72NO11P 809.4843
LMISGP20029BPY PE(18:2(9E,12E)/20:3(7E,10Z,14Z)(5Ep,9Ke){8,12}) 1-(9E,12E-octadecadienoyl)-2-(5,6-epoxycyclopentenone)-sn-glycero-3-phosphoethanolamine C43H70NO10P 791.4737
LMISGP20029BPZ PE(18:2(9E,12E)/20:4(5Z,7E,11Z,14Z)(9Ke)) 1-(9E,12E-octadecadienoyl)-2-(9-Oxo-ETE)-sn-glycero-3-phosphoethanolamine C43H72NO9P 777.4945
LMISGP20029BP0 PE(18:2(9E,12E)/20:4(5Z,7E,11Z,14Z)(9OH[S])) 1-(9E,12E-octadecadienoyl)-2-(9S-HETE)-sn-glycero-3-phosphoethanolamine C43H74NO9P 779.5101
LMISGP20029BP1 PE(18:2(9E,12E)/20:4(5Z,8Z,10E,14Z)(12Ke)) 1-(9E,12E-octadecadienoyl)-2-(12-Oxo-ETE)-sn-glycero-3-phosphoethanolamine C43H72NO9P 777.4945
LMISGP20029BP2 PE(18:2(9E,12E)/20:4(5Z,8Z,10E,14Z)(12OH[S])) 1-(9E,12E-octadecadienoyl)-2-(12S-HETE)-sn-glycero-3-phosphoethanolamine C43H74NO9P 779.5101
LMISGP20029BP3 PE(18:2(9E,12E)/20:4(5Z,8Z,11Z,13E)(15Ke)) 1-(9E,12E-octadecadienoyl)-2-(15-Oxo-ETE)-sn-glycero-3-phosphoethanolamine C43H72NO9P 777.4945
LMISGP20029BP4 PE(18:2(9E,12E)/20:4(5Z,8Z,11Z,13E)(15OH[S])) 1-(9E,12E-octadecadienoyl)-2-(15S-HETE)-sn-glycero-3-phosphoethanolamine C43H74NO9P 779.5101
LMISGP20029BP5 PE(18:2(9E,12E)/20:4(5Z,8Z,12E,14Z)(11Ke)) 1-(9E,12E-octadecadienoyl)-2-(11-oxo-ETE)-sn-glycero-3-phosphoethanolamine C43H72NO9P 777.4945
LMISGP20029BP6 PE(18:2(9E,12E)/20:4(5Z,8Z,12E,14Z)(11OH[S])) 1-(9E,12E-octadecadienoyl)-2-(11S-HETE)-sn-glycero-3-phosphoethanolamine C43H74NO9P 779.5101
LMISGP20029BP7 PE(18:2(9E,12E)/20:4(5Z,9E,11Z,14Z)(8Ke)) 1-(9E,12E-octadecadienoyl)-2-(8-Oxo-ETE)-sn-glycero-3-phosphoethanolamine C43H72NO9P 777.4945
LMISGP20029BP8 PE(18:2(9E,12E)/20:4(5Z,9E,11Z,14Z)(8OH[S])) 1-(9E,12E-octadecadienoyl)-2-(8S-HETE)-sn-glycero-3-phosphoethanolamine C43H74NO9P 779.5101
LMISGP20029BP9 PE(18:2(9E,12E)/20:4(6E,8Z,11Z,14Z)(5Ke)) 1-(9E,12E-octadecadienoyl)-2-(5-Oxo-ETE)-sn-glycero-3-phosphoethanolamine C43H72NO9P 777.4945
LMISGP20029BQA PE(18:2(9E,12E)/20:4(6E,8Z,11Z,14Z)(5OH[S])) 1-(9E,12E-octadecadienoyl)-2-(5S-HETE)-sn-glycero-3-phosphoethanolamine C43H74NO9P 779.5101
LMISGP20029BQB PE(18:2(9E,12E)/22:6(4Z,6E,10Z,13Z,16Z,19Z)(8OH)) 1-(9E,12E-octadecadienoyl)-2-(8-HDoHE)-sn-glycero-3-phosphoethanolamine C45H74NO9P 803.5101
LMISGP20029BQC PE(18:2(9E,12E)/22:6(4Z,7Z,10Z,12E,16Z,19Z)(14OH)) 1-(9E,12E-octadecadienoyl)-2-(14-HDoHE)-sn-glycero-3-phosphoethanolamine C45H74NO9P 803.5101
LMISGP20029BQD PE(18:2(9E,12E)/22:6(4Z,7Z,10Z,13Z,15E,19Z)(17OH)) 1-(9E,12E-octadecadienoyl)-2-(17-HDoHE)-sn-glycero-3-phosphoethanolamine C45H74NO9P 803.5101
LMISGP20029BQE PE(18:2(9E,12E)/22:6(4Z,7Z,10Z,13Z,16Z,18E)(20OH)) 1-(9E,12E-octadecadienoyl)-2-(20-HDoHE)-sn-glycero-3-phosphoethanolamine C45H74NO9P 803.5101
LMISGP20029BQF PE(18:2(9E,12E)/22:6(4Z,7Z,10Z,13Z,17E,19Z)(16OH)) 1-(9E,12E-octadecadienoyl)-2-(16-HDoHE)-sn-glycero-3-phosphoethanolamine C45H74NO9P 803.5101
LMISGP20029BQG PE(18:2(9E,12E)/22:6(4Z,7Z,10Z,14E,16Z,19Z)(13OH)) 1-(9E,12E-octadecadienoyl)-2-(13-HDoHE)-sn-glycero-3-phosphoethanolamine C45H74NO9P 803.5101
LMISGP20029BQH PE(18:2(9E,12E)/22:6(4Z,7Z,11E,13Z,16Z,19Z)(10OH)) 1-(9E,12E-octadecadienoyl)-2-(10-HDoHE)-sn-glycero-3-phosphoethanolamine C45H74NO9P 803.5101