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
LMISGP20029BQI PE(18:2(9E,12E)/22:6(4Z,7Z,9E,13Z,16Z,19Z)(11OH)) 1-(9E,12E-octadecadienoyl)-2-(11-HDoHE)-sn-glycero-3-phosphoethanolamine C45H74NO9P 803.5101
LMISGP20029BQJ PE(18:2(9E,12E)/22:6(4Z,8E,10Z,13Z,16Z,19Z)(7OH)) 1-(9E,12E-octadecadienoyl)-2-(7-HDoHE)-sn-glycero-3-phosphoethanolamine C45H74NO9P 803.5101
LMISGP20029BQK PE(18:2(9E,12E)/22:6(5E,7Z,10Z,13Z,16Z,19Z)(4OH)) 1-(9E,12E-octadecadienoyl)-2-(4-HDoHE)-sn-glycero-3-phosphoethanolamine C45H74NO9P 803.5101
LMISGP20029BRQ PE(18:2(9Z,11Z)/2:0) 1-(9Z,11Z-octadecadienoyl)-2-acetyl-sn-glycero-3-phosphoethanolamine C25H46NO8P 519.2961
LMISGP20029BSJ PE(18:2(9Z,11Z)/4:0) 1-(9Z,11Z-octadecadienoyl)-2-butyryl-sn-glycero-3-phosphoethanolamine C27H50NO8P 547.3274
LMISGP20029BSK PE(18:2(9Z,11Z)/4:1(3E)) 1-(9Z,11Z-octadecadienoyl)-2-3E-butenoyl-sn-glycero-3-phosphoethanolamine C27H48NO8P 545.3118
LMISGP20029BSH PE(18:2(9Z,11Z)/4:0(4Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(4-oxobutyryl)-sn-glycero-3-phosphoethanolamine C27H48NO9P 561.3067
LMISGP20029BSI PE(18:2(9Z,11Z)/4:0(4OH,4Ke)) 1-(9Z,11Z-octadecadienoyl)-2-succinyl-sn-glycero-3-phosphoethanolamine C27H48NO10P 577.3016
LMISGP20029BSL PE(18:2(9Z,11Z)/5:0(5Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(5-oxo-valeroyl)-sn-glycero-3-phosphoethanolamine C28H50NO9P 575.3223
LMISGP20029BSM PE(18:2(9Z,11Z)/5:0(5OH,5Ke)) 1-(9Z,11Z-octadecadienoyl)-2-glutaroyl-sn-glycero-3-phosphoethanolamine C28H50NO10P 591.3172
LMISGP20029BSN PE(18:2(9Z,11Z)/6:1(4E)(3Ke,6OH,6Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(3,6-dioxo-4E-hexenoyl)-sn-glycero-3-phosphoethanolamine C29H48NO11P 617.2965
LMISGP20029BSO PE(18:2(9Z,11Z)/6:1(4E)(6Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(6-oxo-4E-hexenoyl)-sn-glycero-3-phosphoethanolamine C29H50NO9P 587.3223
LMISGP20029BSP PE(18:2(9Z,11Z)/7:1(5E)(4Ke,7Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(4,7-dioxo-5E-heptenoyl)-sn-glycero-3-phosphoethanolamine C30H50NO10P 615.3172
LMISGP20029BSQ PE(18:2(9Z,11Z)/7:1(5E)(4Ke,7OH,7Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(4-keto-6-carboxy-5E-hexenoyl)-sn-glycero-3-phosphoethanolamine C30H50NO11P 631.3122
LMISGP20029BSR PE(18:2(9Z,11Z)/7:1(5E)(4OH,7Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(4-hydroxy-7-oxo-5E-heptenoyl)-sn-glycero-3-phosphoethanolamine C30H52NO10P 617.3329
LMISGP20029BSS PE(18:2(9Z,11Z)/7:1(5E)(4OH,7OH,7Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(4-hydroxy-6-carboxy-5E-hexenoyl)-sn-glycero-3-phosphoethanolamine C30H52NO11P 633.3278
LMISGP20029BST PE(18:2(9Z,11Z)/8:0(8Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(8-Oxo-octanoyl)-sn-glycero-3-phosphoethanolamine C31H56NO9P 617.3693
LMISGP20029BSU PE(18:2(9Z,11Z)/8:0(8OH,8Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(8-Carboxy-heptanoyl)-sn-glycero-3-phosphoethanolamine C31H56NO10P 633.3642
LMISGP20029BSV PE(18:2(9Z,11Z)/8:1(6E)(5Ke,8Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(5,8-dioxo-6E-octenoyl)-sn-glycero-3-phosphoethanolamine C31H52NO10P 629.3329
LMISGP20029BSW PE(18:2(9Z,11Z)/8:1(6E)(5Ke,8OH,8Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(5-keto-7-carboxy-6E-heptenoyl)-sn-glycero-3-phosphoethanolamine C31H52NO11P 645.3278
LMISGP20029BSX PE(18:2(9Z,11Z)/8:1(6E)(5OH,8Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(5-hydroxy-8-oxo-6E-octenoyl)-sn-glycero-3-phosphoethanolamine C31H54NO10P 631.3485
LMISGP20029BSY PE(18:2(9Z,11Z)/8:1(6E)(5OH,8OH,8Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(5-hydroxy-7-carboxy-6E-heptenoyl)-sn-glycero-3-phosphoethanolamine C31H54NO11P 647.3435
LMISGP20029BSZ PE(18:2(9Z,11Z)/9:0(9Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(9-oxo-nonanoyl)-sn-glycero-3-phosphoethanolamine C32H58NO9P 631.3849
LMISGP20029BS0 PE(18:2(9Z,11Z)/9:0(9OH,9Ke)) 1-(9Z,11Z-octadecadienoyl)-2-azeloyl-sn-glycero-3-phosphoethanolamine C32H58NO10P 647.3798
LMISGP20029BS1 PE(18:2(9Z,11Z)/9:2(5E,7E)(4Ke,9Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(4,9-dioxo-5E,7E-nonadienoyl)-sn-glycero-3-phosphoethanolamine C32H52NO10P 641.3329
LMISGP20029BQ6 PE(18:2(9Z,11Z)/11:1(9E)(11Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(11-Oxo-9E-undecenoyl)-sn-glycero-3-phosphoethanolamine C34H60NO9P 657.4006
LMISGP20029BQ7 PE(18:2(9Z,11Z)/11:2(6E,8E)(5OH,10OH,11Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(5,10-Dihydroxy-11-oxo-6E,8E-undecadienoyl)-sn-glycero-3-phosphoethanolamine C34H58NO11P 687.3748
LMISGP20029BQ8 PE(18:2(9Z,11Z)/12:0(9Ke,12Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(9,12-dioxodecanoyl)-sn-glycero-3-phosphoethanolamine C35H62NO10P 687.4111
LMISGP20029BQ9 PE(18:2(9Z,11Z)/12:1(10E)(9Ke,12OH,12Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(9-oxo-11-carboxy-10E-undecenoyl)-sn-glycero-3-phosphoethanolamine C35H60NO11P 701.3904
LMISGP20029BRA PE(18:2(9Z,11Z)/12:1(10E)(9OH,12Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(9-hydroxy-12-oxo-10E-dodecenoyl)-sn-glycero-3-phosphoethanolamine C35H62NO10P 687.4111
LMISGP20029BRB PE(18:2(9Z,11Z)/12:1(10E)(9OH,12OH,12Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(9-hydroxy-11-carboxy-10E-undecenoyl)-sn-glycero-3-phosphoethanolamine C35H62NO11P 703.4061
LMISGP20029BRC PE(18:2(9Z,11Z)/13:2(9E,11E)(13Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(13-oxo-9E,11E-tridecedienoyl)-sn-glycero-3-phosphoethanolamine C36H62NO9P 683.4162
LMISGP20029BRD PE(18:2(9Z,11Z)/13:2(9E,11E)(8Ke,13Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(8,13-dioxo-9E,11E-tridecadienoyl)-sn-glycero-3-phosphoethanolamine C36H60NO10P 697.3955
LMISGP20029BRE PE(18:2(9Z,11Z)/13:2(9E,11E)(8OH,13Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(8-hydroxy-13-oxo-9E,11E-tridecadienoyl)-sn-glycero-3-phosphoethanolamine C36H62NO10P 699.4111
LMISGP20029BRF PE(18:2(9Z,11Z)/13:3(5Z,8E,11E)(10OH,13Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(10-hydroxy-13-oxo-5Z,8E,11E-tridecatrienoyl)-sn-glycero-3-phosphoethanolamine C36H60NO10P 697.3955
LMISGP20029BRG PE(18:2(9Z,11Z)/18:2(10E,12Z)(9OH[R])) 1-(9Z,11Z-octadecadienoyl)-2-(9R-HODE)-sn-glycero-3-phosphoethanolamine C41H74NO9P 755.5101
LMISGP20029BRH PE(18:2(9Z,11Z)/18:2(10E,12Z)(9OH[S])) 1-(9Z,11Z-octadecadienoyl)-2-(9S-HODE)-sn-glycero-3-phosphoethanolamine C41H74NO9P 755.5101
LMISGP20029BRI PE(18:2(9Z,11Z)/18:2(8E,12Z)(10OH[R])) 1-(9Z,11Z-octadecadienoyl)-2-(10R-HODE)-sn-glycero-3-phosphoethanolamine C41H74NO9P 755.5101
LMISGP20029BRJ PE(18:2(9Z,11Z)/18:2(8E,12Z)(10OH[S])) 1-(9Z,11Z-octadecadienoyl)-2-(10S-HODE)-sn-glycero-3-phosphoethanolamine C41H74NO9P 755.5101
LMISGP20029BRK PE(18:2(9Z,11Z)/18:2(9Z,11E)(13OH[R])) 1-(9Z,11Z-octadecadienoyl)-2-(13R-HODE)-sn-glycero-3-phosphoethanolamine C41H74NO9P 755.5101
LMISGP20029BRL PE(18:2(9Z,11Z)/18:2(9Z,11E)(13OH[S])) 1-(9Z,11Z-octadecadienoyl)-2-(13S-HODE)-sn-glycero-3-phosphoethanolamine C41H74NO9P 755.5101
LMISGP20029BRM PE(18:2(9Z,11Z)/18:2(9Z,12Z)(8OH[R])) 1-(9Z,11Z-octadecadienoyl)-2-(8R-HODE)-sn-glycero-3-phosphoethanolamine C41H74NO9P 755.5101
LMISGP20029BRN PE(18:2(9Z,11Z)/18:2(9Z,12Z)(8OH[S])) 1-(9Z,11Z-octadecadienoyl)-2-(8S-HODE)-sn-glycero-3-phosphoethanolamine C41H74NO9P 755.5101
LMISGP20029BRO PE(18:2(9Z,11Z)/18:2(9Z,15Z)(12OH[R])) 1-(9Z,11Z-octadecadienoyl)-2-(12R-HODE)-sn-glycero-3-phosphoethanolamine C41H74NO9P 755.5101
LMISGP20029BRP PE(18:2(9Z,11Z)/18:2(9Z,15Z)(12OH[S])) 1-(9Z,11Z-octadecadienoyl)-2-(12S-HODE)-sn-glycero-3-phosphoethanolamine C41H74NO9P 755.5101
LMISGP20029BRR PE(18:2(9Z,11Z)/20:2(5Z,13E)(11OH[R],9Ke,15OH[S]){8a,12b}) 1-(9Z,11Z-octadecadienoyl)-2-PGE2-sn-glycero-3-phosphoethanolamine C43H74NO11P 811.5000
LMISGP20029BRS PE(18:2(9Z,11Z)/20:2(5Z,13E)(9OH[S],11Ke,15OH[S]){8a,12b}) 1-(9Z,11Z-octadecadienoyl)-2-PGD2-sn-glycero-3-phosphoethanolamine C43H74NO11P 811.5000
LMISGP20029BRT PE(18:2(9Z,11Z)/20:2(7E,14Z)(5Ep,9Ke,11OH){8,12}) 1-(9Z,11Z-octadecadienoyl)-2-(5,6-epoxy-isoPE2)-sn-glycero-3-phosphoethanolamine C43H72NO11P 809.4843
LMISGP20029BRU PE(18:2(9Z,11Z)/20:3(7E,10Z,14Z)(5Ep,9Ke){8,12}) 1-(9Z,11Z-octadecadienoyl)-2-(5,6-epoxycyclopentenone)-sn-glycero-3-phosphoethanolamine C43H70NO10P 791.4737
LMISGP20029BRV PE(18:2(9Z,11Z)/20:4(5Z,7E,11Z,14Z)(9Ke)) 1-(9Z,11Z-octadecadienoyl)-2-(9-Oxo-ETE)-sn-glycero-3-phosphoethanolamine C43H72NO9P 777.4945