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
LMISGP20019CIL PC(20:3(5Z,8Z,11Z)/20:4(6E,8Z,11Z,14Z)(5Ke)) 1-(5Z,8Z,11Z-eicosatrienoyl)-2-(5-Oxo-ETE)-sn-glycero-3-phosphocholine C48H80NO9P 845.5571
LMISGP20019CIM PC(20:3(5Z,8Z,11Z)/20:4(6E,8Z,11Z,14Z)(5OH[S])) 1-(5Z,8Z,11Z-eicosatrienoyl)-2-(5S-HETE)-sn-glycero-3-phosphocholine C48H82NO9P 847.5727
LMISGP20019CIN PC(20:3(5Z,8Z,11Z)/22:6(4Z,6E,10Z,13Z,16Z,19Z)(8OH)) 1-(5Z,8Z,11Z-eicosatrienoyl)-2-(8-HDoHE)-sn-glycero-3-phosphocholine C50H82NO9P 871.5727
LMISGP20019CIO PC(20:3(5Z,8Z,11Z)/22:6(4Z,7Z,10Z,12E,16Z,19Z)(14OH)) 1-(5Z,8Z,11Z-eicosatrienoyl)-2-(14-HDoHE)-sn-glycero-3-phosphocholine C50H82NO9P 871.5727
LMISGP20019CIP PC(20:3(5Z,8Z,11Z)/22:6(4Z,7Z,10Z,13Z,15E,19Z)(17OH)) 1-(5Z,8Z,11Z-eicosatrienoyl)-2-(17-HDoHE)-sn-glycero-3-phosphocholine C50H82NO9P 871.5727
LMISGP20019CIQ PC(20:3(5Z,8Z,11Z)/22:6(4Z,7Z,10Z,13Z,16Z,18E)(20OH)) 1-(5Z,8Z,11Z-eicosatrienoyl)-2-(20-HDoHE)-sn-glycero-3-phosphocholine C50H82NO9P 871.5727
LMISGP20019CIR PC(20:3(5Z,8Z,11Z)/22:6(4Z,7Z,10Z,13Z,17E,19Z)(16OH)) 1-(5Z,8Z,11Z-eicosatrienoyl)-2-(16-HDoHE)-sn-glycero-3-phosphocholine C50H82NO9P 871.5727
LMISGP20019CIS PC(20:3(5Z,8Z,11Z)/22:6(4Z,7Z,10Z,14E,16Z,19Z)(13OH)) 1-(5Z,8Z,11Z-eicosatrienoyl)-2-(13-HDoHE)-sn-glycero-3-phosphocholine C50H82NO9P 871.5727
LMISGP20019CIT PC(20:3(5Z,8Z,11Z)/22:6(4Z,7Z,11E,13Z,16Z,19Z)(10OH)) 1-(5Z,8Z,11Z-eicosatrienoyl)-2-(10-HDoHE)-sn-glycero-3-phosphocholine C50H82NO9P 871.5727
LMISGP20019CIU PC(20:3(5Z,8Z,11Z)/22:6(4Z,7Z,9E,13Z,16Z,19Z)(11OH)) 1-(5Z,8Z,11Z-eicosatrienoyl)-2-(11-HDoHE)-sn-glycero-3-phosphocholine C50H82NO9P 871.5727
LMISGP20019CIV PC(20:3(5Z,8Z,11Z)/22:6(4Z,8E,10Z,13Z,16Z,19Z)(7OH)) 1-(5Z,8Z,11Z-eicosatrienoyl)-2-(7-HDoHE)-sn-glycero-3-phosphocholine C50H82NO9P 871.5727
LMISGP20019CIW PC(20:3(5Z,8Z,11Z)/22:6(5E,7Z,10Z,13Z,16Z,19Z)(4OH)) 1-(5Z,8Z,11Z-eicosatrienoyl)-2-(4-HDoHE)-sn-glycero-3-phosphocholine C50H82NO9P 871.5727
LMISGP20019CJ2 PC(20:3(8Z,11Z,14Z)/2:0) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-acetyl-sn-glycero-3-phosphocholine C30H54NO8P 587.3587
LMISGP20019CKV PC(20:3(8Z,11Z,14Z)/4:0) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-butyryl-sn-glycero-3-phosphocholine C32H58NO8P 615.3900
LMISGP20019CKW PC(20:3(8Z,11Z,14Z)/4:1(3E)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-3E-butenoyl-sn-glycero-3-phosphocholine C32H56NO8P 613.3744
LMISGP20019CKT PC(20:3(8Z,11Z,14Z)/4:0(4Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(4-oxobutyryl)-sn-glycero-3-phosphocholine C32H56NO9P 629.3693
LMISGP20019CKU PC(20:3(8Z,11Z,14Z)/4:0(4OH,4Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-succinyl-sn-glycero-3-phosphocholine C32H56NO10P 645.3642
LMISGP20019CKX PC(20:3(8Z,11Z,14Z)/5:0(5Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(5-oxo-valeroyl)-sn-glycero-3-phosphocholine C33H58NO9P 643.3849
LMISGP20019CKY PC(20:3(8Z,11Z,14Z)/5:0(5OH,5Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-glutaroyl-sn-glycero-3-phosphocholine C33H58NO10P 659.3798
LMISGP20019CKZ PC(20:3(8Z,11Z,14Z)/6:1(4E)(3Ke,6OH,6Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(3,6-dioxo-4E-hexenoyl)-sn-glycero-3-phosphocholine C34H56NO11P 685.3591
LMISGP20019CK0 PC(20:3(8Z,11Z,14Z)/6:1(4E)(6Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(6-oxo-4E-hexenoyl)-sn-glycero-3-phosphocholine C34H58NO9P 655.3849
LMISGP20019CK1 PC(20:3(8Z,11Z,14Z)/7:1(5E)(4Ke,7Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(4,7-dioxo-5E-heptenoyl)-sn-glycero-3-phosphocholine C35H58NO10P 683.3798
LMISGP20019CK2 PC(20:3(8Z,11Z,14Z)/7:1(5E)(4Ke,7OH,7Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(4-keto-6-carboxy-5E-hexenoyl)-sn-glycero-3-phosphocholine C35H58NO11P 699.3748
LMISGP20019CK3 PC(20:3(8Z,11Z,14Z)/7:1(5E)(4OH,7Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(4-hydroxy-7-oxo-5E-heptenoyl)-sn-glycero-3-phosphocholine C35H60NO10P 685.3955
LMISGP20019CK4 PC(20:3(8Z,11Z,14Z)/7:1(5E)(4OH,7OH,7Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(4-hydroxy-6-carboxy-5E-hexenoyl)-sn-glycero-3-phosphocholine C35H60NO11P 701.3904
LMISGP20019CK5 PC(20:3(8Z,11Z,14Z)/8:0(8Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(8-Oxo-octanoyl)-sn-glycero-3-phosphocholine C36H64NO9P 685.4319
LMISGP20019CK6 PC(20:3(8Z,11Z,14Z)/8:0(8OH,8Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(8-Carboxy-heptanoyl)-sn-glycero-3-phosphocholine C36H64NO10P 701.4268
LMISGP20019CK7 PC(20:3(8Z,11Z,14Z)/8:1(6E)(5Ke,8Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(5,8-dioxo-6E-octenoyl)-sn-glycero-3-phosphocholine C36H60NO10P 697.3955
LMISGP20019CK8 PC(20:3(8Z,11Z,14Z)/8:1(6E)(5Ke,8OH,8Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(5-keto-7-carboxy-6E-heptenoyl)-sn-glycero-3-phosphocholine C36H60NO11P 713.3904
LMISGP20019CK9 PC(20:3(8Z,11Z,14Z)/8:1(6E)(5OH,8Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(5-hydroxy-8-oxo-6E-octenoyl)-sn-glycero-3-phosphocholine C36H62NO10P 699.4111
LMISGP20019CLA PC(20:3(8Z,11Z,14Z)/8:1(6E)(5OH,8OH,8Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(5-hydroxy-7-carboxy-6E-heptenoyl)-sn-glycero-3-phosphocholine C36H62NO11P 715.4061
LMISGP20019CLB PC(20:3(8Z,11Z,14Z)/9:0(9Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(9-oxo-nonanoyl)-sn-glycero-3-phosphocholine C37H66NO9P 699.4475
LMISGP20019CLC PC(20:3(8Z,11Z,14Z)/9:0(9OH,9Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-azeloyl-sn-glycero-3-phosphocholine C37H66NO10P 715.4424
LMISGP20019CLD PC(20:3(8Z,11Z,14Z)/9:2(5E,7E)(4Ke,9Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(4,9-dioxo-5E,7E-nonadienoyl)-sn-glycero-3-phosphocholine C37H60NO10P 709.3955
LMISGP20019CJI PC(20:3(8Z,11Z,14Z)/11:1(9E)(11Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(11-Oxo-9E-undecenoyl)-sn-glycero-3-phosphocholine C39H68NO9P 725.4632
LMISGP20019CJJ PC(20:3(8Z,11Z,14Z)/11:2(6E,8E)(5OH,10OH,11Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(5,10-Dihydroxy-11-oxo-6E,8E-undecadienoyl)-sn-glycero-3-phosphocholine C39H66NO11P 755.4374
LMISGP20019CJK PC(20:3(8Z,11Z,14Z)/12:0(9Ke,12Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(9,12-dioxodecanoyl)-sn-glycero-3-phosphocholine C40H70NO10P 755.4737
LMISGP20019CJL PC(20:3(8Z,11Z,14Z)/12:1(10E)(9Ke,12OH,12Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(9-oxo-11-carboxy-10E-undecenoyl)-sn-glycero-3-phosphocholine C40H68NO11P 769.4530
LMISGP20019CJM PC(20:3(8Z,11Z,14Z)/12:1(10E)(9OH,12Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(9-hydroxy-12-oxo-10E-dodecenoyl)-sn-glycero-3-phosphocholine C40H70NO10P 755.4737
LMISGP20019CJN PC(20:3(8Z,11Z,14Z)/12:1(10E)(9OH,12OH,12Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(9-hydroxy-11-carboxy-10E-undecenoyl)-sn-glycero-3-phosphocholine C40H70NO11P 771.4687
LMISGP20019CJO PC(20:3(8Z,11Z,14Z)/13:2(9E,11E)(13Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(13-oxo-9E,11E-tridecedienoyl)-sn-glycero-3-phosphocholine C41H70NO9P 751.4788
LMISGP20019CJP PC(20:3(8Z,11Z,14Z)/13:2(9E,11E)(8Ke,13Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(8,13-dioxo-9E,11E-tridecadienoyl)-sn-glycero-3-phosphocholine C41H68NO10P 765.4581
LMISGP20019CJQ PC(20:3(8Z,11Z,14Z)/13:2(9E,11E)(8OH,13Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(8-hydroxy-13-oxo-9E,11E-tridecadienoyl)-sn-glycero-3-phosphocholine C41H70NO10P 767.4737
LMISGP20019CJR PC(20:3(8Z,11Z,14Z)/13:3(5Z,8E,11E)(10OH,13Ke)) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(10-hydroxy-13-oxo-5Z,8E,11E-tridecatrienoyl)-sn-glycero-3-phosphocholine C41H68NO10P 765.4581
LMISGP20019CJS PC(20:3(8Z,11Z,14Z)/18:2(10E,12Z)(9OH[R])) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(9R-HODE)-sn-glycero-3-phosphocholine C46H82NO9P 823.5727
LMISGP20019CJT PC(20:3(8Z,11Z,14Z)/18:2(10E,12Z)(9OH[S])) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(9S-HODE)-sn-glycero-3-phosphocholine C46H82NO9P 823.5727
LMISGP20019CJU PC(20:3(8Z,11Z,14Z)/18:2(8E,12Z)(10OH[R])) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(10R-HODE)-sn-glycero-3-phosphocholine C46H82NO9P 823.5727
LMISGP20019CJV PC(20:3(8Z,11Z,14Z)/18:2(8E,12Z)(10OH[S])) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(10S-HODE)-sn-glycero-3-phosphocholine C46H82NO9P 823.5727
LMISGP20019CJW PC(20:3(8Z,11Z,14Z)/18:2(9Z,11E)(13OH[R])) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(13R-HODE)-sn-glycero-3-phosphocholine C46H82NO9P 823.5727
LMISGP20019CJX PC(20:3(8Z,11Z,14Z)/18:2(9Z,11E)(13OH[S])) 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(13S-HODE)-sn-glycero-3-phosphocholine C46H82NO9P 823.5727