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
LMISGP20019CSB PC(20:4(5Z,8Z,11Z,14Z)/22:6(4Z,8E,10Z,13Z,16Z,19Z)(7OH)) 1-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-2-(7-HDoHE)-sn-glycero-3-phosphocholine C50H80NO9P 869.5571
LMISGP20019CSC PC(20:4(5Z,8Z,11Z,14Z)/22:6(5E,7Z,10Z,13Z,16Z,19Z)(4OH)) 1-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-2-(4-HDoHE)-sn-glycero-3-phosphocholine C50H80NO9P 869.5571
LMISGP20019CTI PC(20:4(6E,8Z,11Z,14Z)/2:0) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-acetyl-sn-glycero-3-phosphocholine C30H52NO8P 585.3431
LMISGP20019CUB PC(20:4(6E,8Z,11Z,14Z)/4:0) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-butyryl-sn-glycero-3-phosphocholine C32H56NO8P 613.3744
LMISGP20019CUC PC(20:4(6E,8Z,11Z,14Z)/4:1(3E)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-3E-butenoyl-sn-glycero-3-phosphocholine C32H54NO8P 611.3587
LMISGP20019CT9 PC(20:4(6E,8Z,11Z,14Z)/4:0(4Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(4-oxobutyryl)-sn-glycero-3-phosphocholine C32H54NO9P 627.3536
LMISGP20019CUA PC(20:4(6E,8Z,11Z,14Z)/4:0(4OH,4Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-succinyl-sn-glycero-3-phosphocholine C32H54NO10P 643.3485
LMISGP20019CUD PC(20:4(6E,8Z,11Z,14Z)/5:0(5Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(5-oxo-valeroyl)-sn-glycero-3-phosphocholine C33H56NO9P 641.3693
LMISGP20019CUE PC(20:4(6E,8Z,11Z,14Z)/5:0(5OH,5Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-glutaroyl-sn-glycero-3-phosphocholine C33H56NO10P 657.3642
LMISGP20019CUF PC(20:4(6E,8Z,11Z,14Z)/6:1(4E)(3Ke,6OH,6Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(3,6-dioxo-4E-hexenoyl)-sn-glycero-3-phosphocholine C34H54NO11P 683.3435
LMISGP20019CUG PC(20:4(6E,8Z,11Z,14Z)/6:1(4E)(6Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(6-oxo-4E-hexenoyl)-sn-glycero-3-phosphocholine C34H56NO9P 653.3693
LMISGP20019CUH PC(20:4(6E,8Z,11Z,14Z)/7:1(5E)(4Ke,7Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(4,7-dioxo-5E-heptenoyl)-sn-glycero-3-phosphocholine C35H56NO10P 681.3642
LMISGP20019CUI PC(20:4(6E,8Z,11Z,14Z)/7:1(5E)(4Ke,7OH,7Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(4-keto-6-carboxy-5E-hexenoyl)-sn-glycero-3-phosphocholine C35H56NO11P 697.3591
LMISGP20019CUJ PC(20:4(6E,8Z,11Z,14Z)/7:1(5E)(4OH,7Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(4-hydroxy-7-oxo-5E-heptenoyl)-sn-glycero-3-phosphocholine C35H58NO10P 683.3798
LMISGP20019CUK PC(20:4(6E,8Z,11Z,14Z)/7:1(5E)(4OH,7OH,7Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(4-hydroxy-6-carboxy-5E-hexenoyl)-sn-glycero-3-phosphocholine C35H58NO11P 699.3748
LMISGP20019CUL PC(20:4(6E,8Z,11Z,14Z)/8:0(8Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(8-Oxo-octanoyl)-sn-glycero-3-phosphocholine C36H62NO9P 683.4162
LMISGP20019CUM PC(20:4(6E,8Z,11Z,14Z)/8:0(8OH,8Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(8-Carboxy-heptanoyl)-sn-glycero-3-phosphocholine C36H62NO10P 699.4111
LMISGP20019CUN PC(20:4(6E,8Z,11Z,14Z)/8:1(6E)(5Ke,8Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(5,8-dioxo-6E-octenoyl)-sn-glycero-3-phosphocholine C36H58NO10P 695.3798
LMISGP20019CUO PC(20:4(6E,8Z,11Z,14Z)/8:1(6E)(5Ke,8OH,8Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(5-keto-7-carboxy-6E-heptenoyl)-sn-glycero-3-phosphocholine C36H58NO11P 711.3748
LMISGP20019CUP PC(20:4(6E,8Z,11Z,14Z)/8:1(6E)(5OH,8Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(5-hydroxy-8-oxo-6E-octenoyl)-sn-glycero-3-phosphocholine C36H60NO10P 697.3955
LMISGP20019CUQ PC(20:4(6E,8Z,11Z,14Z)/8:1(6E)(5OH,8OH,8Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(5-hydroxy-7-carboxy-6E-heptenoyl)-sn-glycero-3-phosphocholine C36H60NO11P 713.3904
LMISGP20019CUR PC(20:4(6E,8Z,11Z,14Z)/9:0(9Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(9-oxo-nonanoyl)-sn-glycero-3-phosphocholine C37H64NO9P 697.4319
LMISGP20019CUS PC(20:4(6E,8Z,11Z,14Z)/9:0(9OH,9Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-azeloyl-sn-glycero-3-phosphocholine C37H64NO10P 713.4268
LMISGP20019CUT PC(20:4(6E,8Z,11Z,14Z)/9:2(5E,7E)(4Ke,9Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(4,9-dioxo-5E,7E-nonadienoyl)-sn-glycero-3-phosphocholine C37H58NO10P 707.3798
LMISGP20019CSY PC(20:4(6E,8Z,11Z,14Z)/11:1(9E)(11Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(11-Oxo-9E-undecenoyl)-sn-glycero-3-phosphocholine C39H66NO9P 723.4475
LMISGP20019CSZ PC(20:4(6E,8Z,11Z,14Z)/11:2(6E,8E)(5OH,10OH,11Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(5,10-Dihydroxy-11-oxo-6E,8E-undecadienoyl)-sn-glycero-3-phosphocholine C39H64NO11P 753.4217
LMISGP20019CS0 PC(20:4(6E,8Z,11Z,14Z)/12:0(9Ke,12Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(9,12-dioxodecanoyl)-sn-glycero-3-phosphocholine C40H68NO10P 753.4581
LMISGP20019CS1 PC(20:4(6E,8Z,11Z,14Z)/12:1(10E)(9Ke,12OH,12Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(9-oxo-11-carboxy-10E-undecenoyl)-sn-glycero-3-phosphocholine C40H66NO11P 767.4374
LMISGP20019CS2 PC(20:4(6E,8Z,11Z,14Z)/12:1(10E)(9OH,12Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(9-hydroxy-12-oxo-10E-dodecenoyl)-sn-glycero-3-phosphocholine C40H68NO10P 753.4581
LMISGP20019CS3 PC(20:4(6E,8Z,11Z,14Z)/12:1(10E)(9OH,12OH,12Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(9-hydroxy-11-carboxy-10E-undecenoyl)-sn-glycero-3-phosphocholine C40H68NO11P 769.4530
LMISGP20019CS4 PC(20:4(6E,8Z,11Z,14Z)/13:2(9E,11E)(13Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(13-oxo-9E,11E-tridecedienoyl)-sn-glycero-3-phosphocholine C41H68NO9P 749.4632
LMISGP20019CS5 PC(20:4(6E,8Z,11Z,14Z)/13:2(9E,11E)(8Ke,13Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(8,13-dioxo-9E,11E-tridecadienoyl)-sn-glycero-3-phosphocholine C41H66NO10P 763.4424
LMISGP20019CS6 PC(20:4(6E,8Z,11Z,14Z)/13:2(9E,11E)(8OH,13Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(8-hydroxy-13-oxo-9E,11E-tridecadienoyl)-sn-glycero-3-phosphocholine C41H68NO10P 765.4581
LMISGP20019CS7 PC(20:4(6E,8Z,11Z,14Z)/13:3(5Z,8E,11E)(10OH,13Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(10-hydroxy-13-oxo-5Z,8E,11E-tridecatrienoyl)-sn-glycero-3-phosphocholine C41H66NO10P 763.4424
LMISGP20019CS8 PC(20:4(6E,8Z,11Z,14Z)/18:2(10E,12Z)(9OH[R])) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(9R-HODE)-sn-glycero-3-phosphocholine C46H80NO9P 821.5571
LMISGP20019CS9 PC(20:4(6E,8Z,11Z,14Z)/18:2(10E,12Z)(9OH[S])) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(9S-HODE)-sn-glycero-3-phosphocholine C46H80NO9P 821.5571
LMISGP20019CTA PC(20:4(6E,8Z,11Z,14Z)/18:2(8E,12Z)(10OH[R])) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(10R-HODE)-sn-glycero-3-phosphocholine C46H80NO9P 821.5571
LMISGP20019CTB PC(20:4(6E,8Z,11Z,14Z)/18:2(8E,12Z)(10OH[S])) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(10S-HODE)-sn-glycero-3-phosphocholine C46H80NO9P 821.5571
LMISGP20019CTC PC(20:4(6E,8Z,11Z,14Z)/18:2(9Z,11E)(13OH[R])) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(13R-HODE)-sn-glycero-3-phosphocholine C46H80NO9P 821.5571
LMISGP20019CTD PC(20:4(6E,8Z,11Z,14Z)/18:2(9Z,11E)(13OH[S])) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(13S-HODE)-sn-glycero-3-phosphocholine C46H80NO9P 821.5571
LMISGP20019CTE PC(20:4(6E,8Z,11Z,14Z)/18:2(9Z,12Z)(8OH[R])) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(8R-HODE)-sn-glycero-3-phosphocholine C46H80NO9P 821.5571
LMISGP20019CTF PC(20:4(6E,8Z,11Z,14Z)/18:2(9Z,12Z)(8OH[S])) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(8S-HODE)-sn-glycero-3-phosphocholine C46H80NO9P 821.5571
LMISGP20019CTG PC(20:4(6E,8Z,11Z,14Z)/18:2(9Z,15Z)(12OH[R])) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(12R-HODE)-sn-glycero-3-phosphocholine C46H80NO9P 821.5571
LMISGP20019CTH PC(20:4(6E,8Z,11Z,14Z)/18:2(9Z,15Z)(12OH[S])) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(12S-HODE)-sn-glycero-3-phosphocholine C46H80NO9P 821.5571
LMISGP20019CTJ PC(20:4(6E,8Z,11Z,14Z)/20:2(5Z,13E)(11OH[R],9Ke,15OH[S]){8a,12b}) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-PGE2-sn-glycero-3-phosphocholine C48H80NO11P 877.5469
LMISGP20019CTK PC(20:4(6E,8Z,11Z,14Z)/20:2(5Z,13E)(9OH[S],11Ke,15OH[S]){8a,12b}) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-PGD2-sn-glycero-3-phosphocholine C48H80NO11P 877.5469
LMISGP20019CTL PC(20:4(6E,8Z,11Z,14Z)/20:2(7E,14Z)(5Ep,9Ke,11OH){8,12}) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(5,6-epoxy-isoPE2)-sn-glycero-3-phosphocholine C48H78NO11P 875.5313
LMISGP20019CTM PC(20:4(6E,8Z,11Z,14Z)/20:3(7E,10Z,14Z)(5Ep,9Ke){8,12}) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(5,6-epoxycyclopentenone)-sn-glycero-3-phosphocholine C48H76NO10P 857.5207
LMISGP20019CTN PC(20:4(6E,8Z,11Z,14Z)/20:4(5Z,7E,11Z,14Z)(9Ke)) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(9-Oxo-ETE)-sn-glycero-3-phosphocholine C48H78NO9P 843.5414
LMISGP20019CTO PC(20:4(6E,8Z,11Z,14Z)/20:4(5Z,7E,11Z,14Z)(9OH[S])) 1-(6E,8Z,11Z,14Z-eicosatetraenoyl)-2-(9S-HETE)-sn-glycero-3-phosphocholine C48H80NO9P 845.5571