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
LMISGP20019DZW PC(27:0/4:1(3E)) 1-heptacosanoyl-2-3E-butenoyl-sn-glycero-3-phosphocholine C39H76NO8P 717.5309
LMISGP20019DZT PC(27:0/4:0(4Ke)) 1-heptacosanoyl-2-(4-oxobutyryl)-sn-glycero-3-phosphocholine C39H76NO9P 733.5258
LMISGP20019DZU PC(27:0/4:0(4OH,4Ke)) 1-heptacosanoyl-2-succinyl-sn-glycero-3-phosphocholine C39H76NO10P 749.5207
LMISGP20019DZX PC(27:0/5:0(5Ke)) 1-heptacosanoyl-2-(5-oxo-valeroyl)-sn-glycero-3-phosphocholine C40H78NO9P 747.5414
LMISGP20019DZY PC(27:0/5:0(5OH,5Ke)) 1-heptacosanoyl-2-glutaroyl-sn-glycero-3-phosphocholine C40H78NO10P 763.5363
LMISGP20019DZZ PC(27:0/6:1(4E)(3Ke,6OH,6Ke)) 1-heptacosanoyl-2-(3,6-dioxo-4E-hexenoyl)-sn-glycero-3-phosphocholine C41H76NO11P 789.5156
LMISGP20019DZ0 PC(27:0/6:1(4E)(6Ke)) 1-heptacosanoyl-2-(6-oxo-4E-hexenoyl)-sn-glycero-3-phosphocholine C41H78NO9P 759.5414
LMISGP20019DZ1 PC(27:0/7:1(5E)(4Ke,7Ke)) 1-heptacosanoyl-2-(4,7-dioxo-5E-heptenoyl)-sn-glycero-3-phosphocholine C42H78NO10P 787.5363
LMISGP20019DZ2 PC(27:0/7:1(5E)(4Ke,7OH,7Ke)) 1-heptacosanoyl-2-(4-keto-6-carboxy-5E-hexenoyl)-sn-glycero-3-phosphocholine C42H78NO11P 803.5313
LMISGP20019DZ3 PC(27:0/7:1(5E)(4OH,7Ke)) 1-heptacosanoyl-2-(4-hydroxy-7-oxo-5E-heptenoyl)-sn-glycero-3-phosphocholine C42H80NO10P 789.5520
LMISGP20019DZ4 PC(27:0/7:1(5E)(4OH,7OH,7Ke)) 1-heptacosanoyl-2-(4-hydroxy-6-carboxy-5E-hexenoyl)-sn-glycero-3-phosphocholine C42H80NO11P 805.5469
LMISGP20019DZ5 PC(27:0/8:0(8Ke)) 1-heptacosanoyl-2-(8-Oxo-octanoyl)-sn-glycero-3-phosphocholine C43H84NO9P 789.5884
LMISGP20019DZ6 PC(27:0/8:0(8OH,8Ke)) 1-heptacosanoyl-2-(8-Carboxy-heptanoyl)-sn-glycero-3-phosphocholine C43H84NO10P 805.5833
LMISGP20019DZ7 PC(27:0/8:1(6E)(5Ke,8Ke)) 1-heptacosanoyl-2-(5,8-dioxo-6E-octenoyl)-sn-glycero-3-phosphocholine C43H80NO10P 801.5520
LMISGP20019DZ8 PC(27:0/8:1(6E)(5Ke,8OH,8Ke)) 1-heptacosanoyl-2-(5-keto-7-carboxy-6E-heptenoyl)-sn-glycero-3-phosphocholine C43H80NO11P 817.5469
LMISGP20019DZ9 PC(27:0/8:1(6E)(5OH,8Ke)) 1-heptacosanoyl-2-(5-hydroxy-8-oxo-6E-octenoyl)-sn-glycero-3-phosphocholine C43H82NO10P 803.5676
LMISGP20019D0A PC(27:0/8:1(6E)(5OH,8OH,8Ke)) 1-heptacosanoyl-2-(5-hydroxy-7-carboxy-6E-heptenoyl)-sn-glycero-3-phosphocholine C43H82NO11P 819.5626
LMISGP20019D0B PC(27:0/9:0(9Ke)) 1-heptacosanoyl-2-(9-oxo-nonanoyl)-sn-glycero-3-phosphocholine C44H86NO9P 803.6040
LMISGP20019D0C PC(27:0/9:0(9OH,9Ke)) 1-heptacosanoyl-2-azeloyl-sn-glycero-3-phosphocholine C44H86NO10P 819.5989
LMISGP20019D0D PC(27:0/9:2(5E,7E)(4Ke,9Ke)) 1-heptacosanoyl-2-(4,9-dioxo-5E,7E-nonadienoyl)-sn-glycero-3-phosphocholine C44H80NO10P 813.5520
LMISGP20019DYI PC(27:0/11:1(9E)(11Ke)) 1-heptacosanoyl-2-(11-Oxo-9E-undecenoyl)-sn-glycero-3-phosphocholine C46H88NO9P 829.6197
LMISGP20019DYJ PC(27:0/11:2(6E,8E)(5OH,10OH,11Ke)) 1-heptacosanoyl-2-(5,10-Dihydroxy-11-oxo-6E,8E-undecadienoyl)-sn-glycero-3-phosphocholine C46H86NO11P 859.5939
LMISGP20019DYK PC(27:0/12:0(9Ke,12Ke)) 1-heptacosanoyl-2-(9,12-dioxodecanoyl)-sn-glycero-3-phosphocholine C47H90NO10P 859.6302
LMISGP20019DYL PC(27:0/12:1(10E)(9Ke,12OH,12Ke)) 1-heptacosanoyl-2-(9-oxo-11-carboxy-10E-undecenoyl)-sn-glycero-3-phosphocholine C47H88NO11P 873.6095
LMISGP20019DYM PC(27:0/12:1(10E)(9OH,12Ke)) 1-heptacosanoyl-2-(9-hydroxy-12-oxo-10E-dodecenoyl)-sn-glycero-3-phosphocholine C47H90NO10P 859.6302
LMISGP20019DYN PC(27:0/12:1(10E)(9OH,12OH,12Ke)) 1-heptacosanoyl-2-(9-hydroxy-11-carboxy-10E-undecenoyl)-sn-glycero-3-phosphocholine C47H90NO11P 875.6252
LMISGP20019DYO PC(27:0/13:2(9E,11E)(13Ke)) 1-heptacosanoyl-2-(13-oxo-9E,11E-tridecedienoyl)-sn-glycero-3-phosphocholine C48H90NO9P 855.6353
LMISGP20019DYP PC(27:0/13:2(9E,11E)(8Ke,13Ke)) 1-heptacosanoyl-2-(8,13-dioxo-9E,11E-tridecadienoyl)-sn-glycero-3-phosphocholine C48H88NO10P 869.6146
LMISGP20019DYQ PC(27:0/13:2(9E,11E)(8OH,13Ke)) 1-heptacosanoyl-2-(8-hydroxy-13-oxo-9E,11E-tridecadienoyl)-sn-glycero-3-phosphocholine C48H90NO10P 871.6302
LMISGP20019DYR PC(27:0/13:3(5Z,8E,11E)(10OH,13Ke)) 1-heptacosanoyl-2-(10-hydroxy-13-oxo-5Z,8E,11E-tridecatrienoyl)-sn-glycero-3-phosphocholine C48H88NO10P 869.6146
LMISGP20019DYS PC(27:0/18:2(10E,12Z)(9OH[R])) 1-heptacosanoyl-2-(9R-HODE)-sn-glycero-3-phosphocholine C53H102NO9P 927.7292
LMISGP20019DYT PC(27:0/18:2(10E,12Z)(9OH[S])) 1-heptacosanoyl-2-(9S-HODE)-sn-glycero-3-phosphocholine C53H102NO9P 927.7292
LMISGP20019DYU PC(27:0/18:2(8E,12Z)(10OH[R])) 1-heptacosanoyl-2-(10R-HODE)-sn-glycero-3-phosphocholine C53H102NO9P 927.7292
LMISGP20019DYV PC(27:0/18:2(8E,12Z)(10OH[S])) 1-heptacosanoyl-2-(10S-HODE)-sn-glycero-3-phosphocholine C53H102NO9P 927.7292
LMISGP20019DYW PC(27:0/18:2(9Z,11E)(13OH[R])) 1-heptacosanoyl-2-(13R-HODE)-sn-glycero-3-phosphocholine C53H102NO9P 927.7292
LMISGP20019DYX PC(27:0/18:2(9Z,11E)(13OH[S])) 1-heptacosanoyl-2-(13S-HODE)-sn-glycero-3-phosphocholine C53H102NO9P 927.7292
LMISGP20019DYY PC(27:0/18:2(9Z,12Z)(8OH[R])) 1-heptacosanoyl-2-(8R-HODE)-sn-glycero-3-phosphocholine C53H102NO9P 927.7292
LMISGP20019DYZ PC(27:0/18:2(9Z,12Z)(8OH[S])) 1-heptacosanoyl-2-(8S-HODE)-sn-glycero-3-phosphocholine C53H102NO9P 927.7292
LMISGP20019DY0 PC(27:0/18:2(9Z,15Z)(12OH[R])) 1-heptacosanoyl-2-(12R-HODE)-sn-glycero-3-phosphocholine C53H102NO9P 927.7292
LMISGP20019DY1 PC(27:0/18:2(9Z,15Z)(12OH[S])) 1-heptacosanoyl-2-(12S-HODE)-sn-glycero-3-phosphocholine C53H102NO9P 927.7292
LMISGP20019DY3 PC(27:0/20:2(5Z,13E)(11OH[R],9Ke,15OH[S]){8a,12b}) 1-heptacosanoyl-2-PGE2-sn-glycero-3-phosphocholine C55H102NO11P 983.7191
LMISGP20019DY4 PC(27:0/20:2(5Z,13E)(9OH[S],11Ke,15OH[S]){8a,12b}) 1-heptacosanoyl-2-PGD2-sn-glycero-3-phosphocholine C55H102NO11P 983.7191
LMISGP20019DY5 PC(27:0/20:2(7E,14Z)(5Ep,9Ke,11OH){8,12}) 1-heptacosanoyl-2-(5,6-epoxy-isoPE2)-sn-glycero-3-phosphocholine C55H100NO11P 981.7034
LMISGP20019DY6 PC(27:0/20:3(7E,10Z,14Z)(5Ep,9Ke){8,12}) 1-heptacosanoyl-2-(5,6-epoxycyclopentenone)-sn-glycero-3-phosphocholine C55H98NO10P 963.6928
LMISGP20019DY7 PC(27:0/20:4(5Z,7E,11Z,14Z)(9Ke)) 1-heptacosanoyl-2-(9-Oxo-ETE)-sn-glycero-3-phosphocholine C55H100NO9P 949.7136
LMISGP20019DY8 PC(27:0/20:4(5Z,7E,11Z,14Z)(9OH[S])) 1-heptacosanoyl-2-(9S-HETE)-sn-glycero-3-phosphocholine C55H102NO9P 951.7292
LMISGP20019DY9 PC(27:0/20:4(5Z,8Z,10E,14Z)(12Ke)) 1-heptacosanoyl-2-(12-Oxo-ETE)-sn-glycero-3-phosphocholine C55H100NO9P 949.7136
LMISGP20019DZA PC(27:0/20:4(5Z,8Z,10E,14Z)(12OH[S])) 1-heptacosanoyl-2-(12S-HETE)-sn-glycero-3-phosphocholine C55H102NO9P 951.7292
LMISGP20019DZB PC(27:0/20:4(5Z,8Z,11Z,13E)(15Ke)) 1-heptacosanoyl-2-(15-Oxo-ETE)-sn-glycero-3-phosphocholine C55H100NO9P 949.7136
LMISGP20019DZC PC(27:0/20:4(5Z,8Z,11Z,13E)(15OH[S])) 1-heptacosanoyl-2-(15S-HETE)-sn-glycero-3-phosphocholine C55H102NO9P 951.7292