In-Silico Structure Database (LMISSD)

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LMISSD: Lipid Classification search results

Glycerophospholipids [GP](W)  --> Oxidized glycerophospholipids [GP20] --> Oxidized glycerophosphocholines [GP2001]

LM_ID Common Name Systematic Name Formula Mass
LMISGP20019BX5 PC(18:3(9Z,12Z,15Z)/4:0(4Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(4-oxobutyryl)-sn-glycero-3-phosphocholine C30H52NO9P 601.3380
LMISGP20019BX6 PC(18:3(9Z,12Z,15Z)/4:0(4OH,4Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-succinyl-sn-glycero-3-phosphocholine C30H52NO10P 617.3329
LMISGP20019BX9 PC(18:3(9Z,12Z,15Z)/5:0(5Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(5-oxo-valeroyl)-sn-glycero-3-phosphocholine C31H54NO9P 615.3536
LMISGP20019BYA PC(18:3(9Z,12Z,15Z)/5:0(5OH,5Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-glutaroyl-sn-glycero-3-phosphocholine C31H54NO10P 631.3485
LMISGP20019BYB PC(18:3(9Z,12Z,15Z)/6:1(4E)(3Ke,6OH,6Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(3,6-dioxo-4E-hexenoyl)-sn-glycero-3-phosphocholine C32H52NO11P 657.3278
LMISGP20019BYC PC(18:3(9Z,12Z,15Z)/6:1(4E)(6Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(6-oxo-4E-hexenoyl)-sn-glycero-3-phosphocholine C32H54NO9P 627.3536
LMISGP20019BYD PC(18:3(9Z,12Z,15Z)/7:1(5E)(4Ke,7Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(4,7-dioxo-5E-heptenoyl)-sn-glycero-3-phosphocholine C33H54NO10P 655.3485
LMISGP20019BYE PC(18:3(9Z,12Z,15Z)/7:1(5E)(4Ke,7OH,7Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(4-keto-6-carboxy-5E-hexenoyl)-sn-glycero-3-phosphocholine C33H54NO11P 671.3435
LMISGP20019BYF PC(18:3(9Z,12Z,15Z)/7:1(5E)(4OH,7Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(4-hydroxy-7-oxo-5E-heptenoyl)-sn-glycero-3-phosphocholine C33H56NO10P 657.3642
LMISGP20019BYG PC(18:3(9Z,12Z,15Z)/7:1(5E)(4OH,7OH,7Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(4-hydroxy-6-carboxy-5E-hexenoyl)-sn-glycero-3-phosphocholine C33H56NO11P 673.3591
LMISGP20019BYH PC(18:3(9Z,12Z,15Z)/8:0(8Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(8-Oxo-octanoyl)-sn-glycero-3-phosphocholine C34H60NO9P 657.4006
LMISGP20019BYI PC(18:3(9Z,12Z,15Z)/8:0(8OH,8Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(8-Carboxy-heptanoyl)-sn-glycero-3-phosphocholine C34H60NO10P 673.3955
LMISGP20019BYJ PC(18:3(9Z,12Z,15Z)/8:1(6E)(5Ke,8Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(5,8-dioxo-6E-octenoyl)-sn-glycero-3-phosphocholine C34H56NO10P 669.3642
LMISGP20019BYK PC(18:3(9Z,12Z,15Z)/8:1(6E)(5Ke,8OH,8Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(5-keto-7-carboxy-6E-heptenoyl)-sn-glycero-3-phosphocholine C34H56NO11P 685.3591
LMISGP20019BYL PC(18:3(9Z,12Z,15Z)/8:1(6E)(5OH,8Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(5-hydroxy-8-oxo-6E-octenoyl)-sn-glycero-3-phosphocholine C34H58NO10P 671.3798
LMISGP20019BYM PC(18:3(9Z,12Z,15Z)/8:1(6E)(5OH,8OH,8Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(5-hydroxy-7-carboxy-6E-heptenoyl)-sn-glycero-3-phosphocholine C34H58NO11P 687.3748
LMISGP20019BYN PC(18:3(9Z,12Z,15Z)/9:0(9Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(9-oxo-nonanoyl)-sn-glycero-3-phosphocholine C35H62NO9P 671.4162
LMISGP20019BYO PC(18:3(9Z,12Z,15Z)/9:0(9OH,9Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-azeloyl-sn-glycero-3-phosphocholine C35H62NO10P 687.4111
LMISGP20019BYP PC(18:3(9Z,12Z,15Z)/9:2(5E,7E)(4Ke,9Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(4,9-dioxo-5E,7E-nonadienoyl)-sn-glycero-3-phosphocholine C35H56NO10P 681.3642
LMISGP20019BWU PC(18:3(9Z,12Z,15Z)/11:1(9E)(11Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(11-Oxo-9E-undecenoyl)-sn-glycero-3-phosphocholine C37H64NO9P 697.4319
LMISGP20019BWV PC(18:3(9Z,12Z,15Z)/11:2(6E,8E)(5OH,10OH,11Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(5,10-Dihydroxy-11-oxo-6E,8E-undecadienoyl)-sn-glycero-3-phosphocholine C37H62NO11P 727.4061
LMISGP20019BWW PC(18:3(9Z,12Z,15Z)/12:0(9Ke,12Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(9,12-dioxodecanoyl)-sn-glycero-3-phosphocholine C38H66NO10P 727.4424
LMISGP20019BWX PC(18:3(9Z,12Z,15Z)/12:1(10E)(9Ke,12OH,12Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(9-oxo-11-carboxy-10E-undecenoyl)-sn-glycero-3-phosphocholine C38H64NO11P 741.4217
LMISGP20019BWY PC(18:3(9Z,12Z,15Z)/12:1(10E)(9OH,12Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(9-hydroxy-12-oxo-10E-dodecenoyl)-sn-glycero-3-phosphocholine C38H66NO10P 727.4424
LMISGP20019BWZ PC(18:3(9Z,12Z,15Z)/12:1(10E)(9OH,12OH,12Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(9-hydroxy-11-carboxy-10E-undecenoyl)-sn-glycero-3-phosphocholine C38H66NO11P 743.4374
LMISGP20019BW0 PC(18:3(9Z,12Z,15Z)/13:2(9E,11E)(13Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(13-oxo-9E,11E-tridecedienoyl)-sn-glycero-3-phosphocholine C39H66NO9P 723.4475
LMISGP20019BW1 PC(18:3(9Z,12Z,15Z)/13:2(9E,11E)(8Ke,13Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(8,13-dioxo-9E,11E-tridecadienoyl)-sn-glycero-3-phosphocholine C39H64NO10P 737.4268
LMISGP20019BW2 PC(18:3(9Z,12Z,15Z)/13:2(9E,11E)(8OH,13Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(8-hydroxy-13-oxo-9E,11E-tridecadienoyl)-sn-glycero-3-phosphocholine C39H66NO10P 739.4424
LMISGP20019BW3 PC(18:3(9Z,12Z,15Z)/13:3(5Z,8E,11E)(10OH,13Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(10-hydroxy-13-oxo-5Z,8E,11E-tridecatrienoyl)-sn-glycero-3-phosphocholine C39H64NO10P 737.4268
LMISGP20019BW4 PC(18:3(9Z,12Z,15Z)/18:2(10E,12Z)(9OH[R])) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(9R-HODE)-sn-glycero-3-phosphocholine C44H78NO9P 795.5414
LMISGP20019BW5 PC(18:3(9Z,12Z,15Z)/18:2(10E,12Z)(9OH[S])) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(9S-HODE)-sn-glycero-3-phosphocholine C44H78NO9P 795.5414
LMISGP20019BW6 PC(18:3(9Z,12Z,15Z)/18:2(8E,12Z)(10OH[R])) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(10R-HODE)-sn-glycero-3-phosphocholine C44H78NO9P 795.5414
LMISGP20019BW7 PC(18:3(9Z,12Z,15Z)/18:2(8E,12Z)(10OH[S])) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(10S-HODE)-sn-glycero-3-phosphocholine C44H78NO9P 795.5414
LMISGP20019BW8 PC(18:3(9Z,12Z,15Z)/18:2(9Z,11E)(13OH[R])) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(13R-HODE)-sn-glycero-3-phosphocholine C44H78NO9P 795.5414
LMISGP20019BW9 PC(18:3(9Z,12Z,15Z)/18:2(9Z,11E)(13OH[S])) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(13S-HODE)-sn-glycero-3-phosphocholine C44H78NO9P 795.5414
LMISGP20019BXA PC(18:3(9Z,12Z,15Z)/18:2(9Z,12Z)(8OH[R])) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(8R-HODE)-sn-glycero-3-phosphocholine C44H78NO9P 795.5414
LMISGP20019BXB PC(18:3(9Z,12Z,15Z)/18:2(9Z,12Z)(8OH[S])) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(8S-HODE)-sn-glycero-3-phosphocholine C44H78NO9P 795.5414
LMISGP20019BXC PC(18:3(9Z,12Z,15Z)/18:2(9Z,15Z)(12OH[R])) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(12R-HODE)-sn-glycero-3-phosphocholine C44H78NO9P 795.5414
LMISGP20019BXD PC(18:3(9Z,12Z,15Z)/18:2(9Z,15Z)(12OH[S])) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(12S-HODE)-sn-glycero-3-phosphocholine C44H78NO9P 795.5414
LMISGP20019BXF PC(18:3(9Z,12Z,15Z)/20:2(5Z,13E)(11OH[R],9Ke,15OH[S]){8a,12b}) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-PGE2-sn-glycero-3-phosphocholine C46H78NO11P 851.5313
LMISGP20019BXG PC(18:3(9Z,12Z,15Z)/20:2(5Z,13E)(9OH[S],11Ke,15OH[S]){8a,12b}) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-PGD2-sn-glycero-3-phosphocholine C46H78NO11P 851.5313
LMISGP20019BXH PC(18:3(9Z,12Z,15Z)/20:2(7E,14Z)(5Ep,9Ke,11OH){8,12}) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(5,6-epoxy-isoPE2)-sn-glycero-3-phosphocholine C46H76NO11P 849.5156
LMISGP20019BXI PC(18:3(9Z,12Z,15Z)/20:3(7E,10Z,14Z)(5Ep,9Ke){8,12}) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(5,6-epoxycyclopentenone)-sn-glycero-3-phosphocholine C46H74NO10P 831.5050
LMISGP20019BXJ PC(18:3(9Z,12Z,15Z)/20:4(5Z,7E,11Z,14Z)(9Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(9-Oxo-ETE)-sn-glycero-3-phosphocholine C46H76NO9P 817.5258
LMISGP20019BXK PC(18:3(9Z,12Z,15Z)/20:4(5Z,7E,11Z,14Z)(9OH[S])) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(9S-HETE)-sn-glycero-3-phosphocholine C46H78NO9P 819.5414
LMISGP20019BXL PC(18:3(9Z,12Z,15Z)/20:4(5Z,8Z,10E,14Z)(12Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(12-Oxo-ETE)-sn-glycero-3-phosphocholine C46H76NO9P 817.5258
LMISGP20019BXM PC(18:3(9Z,12Z,15Z)/20:4(5Z,8Z,10E,14Z)(12OH[S])) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(12S-HETE)-sn-glycero-3-phosphocholine C46H78NO9P 819.5414
LMISGP20019BXN PC(18:3(9Z,12Z,15Z)/20:4(5Z,8Z,11Z,13E)(15Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(15-Oxo-ETE)-sn-glycero-3-phosphocholine C46H76NO9P 817.5258
LMISGP20019BXO PC(18:3(9Z,12Z,15Z)/20:4(5Z,8Z,11Z,13E)(15OH[S])) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(15S-HETE)-sn-glycero-3-phosphocholine C46H78NO9P 819.5414
LMISGP20019BXP PC(18:3(9Z,12Z,15Z)/20:4(5Z,8Z,12E,14Z)(11Ke)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(11-oxo-ETE)-sn-glycero-3-phosphocholine C46H76NO9P 817.5258