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
LMISGP20019CDI PC(20:1(13Z)/7:1(5E)(4Ke,7OH,7Ke)) 1-(13Z-eicosenoyl)-2-(4-keto-6-carboxy-5E-hexenoyl)-sn-glycero-3-phosphocholine C35H62NO11P 703.4061
LMISGP20019CDJ PC(20:1(13Z)/7:1(5E)(4OH,7Ke)) 1-(13Z-eicosenoyl)-2-(4-hydroxy-7-oxo-5E-heptenoyl)-sn-glycero-3-phosphocholine C35H64NO10P 689.4268
LMISGP20019CDK PC(20:1(13Z)/7:1(5E)(4OH,7OH,7Ke)) 1-(13Z-eicosenoyl)-2-(4-hydroxy-6-carboxy-5E-hexenoyl)-sn-glycero-3-phosphocholine C35H64NO11P 705.4217
LMISGP20019CDL PC(20:1(13Z)/8:0(8Ke)) 1-(13Z-eicosenoyl)-2-(8-Oxo-octanoyl)-sn-glycero-3-phosphocholine C36H68NO9P 689.4632
LMISGP20019CDM PC(20:1(13Z)/8:0(8OH,8Ke)) 1-(13Z-eicosenoyl)-2-(8-Carboxy-heptanoyl)-sn-glycero-3-phosphocholine C36H68NO10P 705.4581
LMISGP20019CDN PC(20:1(13Z)/8:1(6E)(5Ke,8Ke)) 1-(13Z-eicosenoyl)-2-(5,8-dioxo-6E-octenoyl)-sn-glycero-3-phosphocholine C36H64NO10P 701.4268
LMISGP20019CDO PC(20:1(13Z)/8:1(6E)(5Ke,8OH,8Ke)) 1-(13Z-eicosenoyl)-2-(5-keto-7-carboxy-6E-heptenoyl)-sn-glycero-3-phosphocholine C36H64NO11P 717.4217
LMISGP20019CDP PC(20:1(13Z)/8:1(6E)(5OH,8Ke)) 1-(13Z-eicosenoyl)-2-(5-hydroxy-8-oxo-6E-octenoyl)-sn-glycero-3-phosphocholine C36H66NO10P 703.4424
LMISGP20019CDQ PC(20:1(13Z)/8:1(6E)(5OH,8OH,8Ke)) 1-(13Z-eicosenoyl)-2-(5-hydroxy-7-carboxy-6E-heptenoyl)-sn-glycero-3-phosphocholine C36H66NO11P 719.4374
LMISGP20019CDR PC(20:1(13Z)/9:0(9Ke)) 1-(13Z-eicosenoyl)-2-(9-oxo-nonanoyl)-sn-glycero-3-phosphocholine C37H70NO9P 703.4788
LMISGP20019CDS PC(20:1(13Z)/9:0(9OH,9Ke)) 1-(13Z-eicosenoyl)-2-azeloyl-sn-glycero-3-phosphocholine C37H70NO10P 719.4737
LMISGP20019CDT PC(20:1(13Z)/9:2(5E,7E)(4Ke,9Ke)) 1-(13Z-eicosenoyl)-2-(4,9-dioxo-5E,7E-nonadienoyl)-sn-glycero-3-phosphocholine C37H64NO10P 713.4268
LMISGP20019CBY PC(20:1(13Z)/11:1(9E)(11Ke)) 1-(13Z-eicosenoyl)-2-(11-Oxo-9E-undecenoyl)-sn-glycero-3-phosphocholine C39H72NO9P 729.4945
LMISGP20019CBZ PC(20:1(13Z)/11:2(6E,8E)(5OH,10OH,11Ke)) 1-(13Z-eicosenoyl)-2-(5,10-Dihydroxy-11-oxo-6E,8E-undecadienoyl)-sn-glycero-3-phosphocholine C39H70NO11P 759.4687
LMISGP20019CB0 PC(20:1(13Z)/12:0(9Ke,12Ke)) 1-(13Z-eicosenoyl)-2-(9,12-dioxodecanoyl)-sn-glycero-3-phosphocholine C40H74NO10P 759.5050
LMISGP20019CB1 PC(20:1(13Z)/12:1(10E)(9Ke,12OH,12Ke)) 1-(13Z-eicosenoyl)-2-(9-oxo-11-carboxy-10E-undecenoyl)-sn-glycero-3-phosphocholine C40H72NO11P 773.4843
LMISGP20019CB2 PC(20:1(13Z)/12:1(10E)(9OH,12Ke)) 1-(13Z-eicosenoyl)-2-(9-hydroxy-12-oxo-10E-dodecenoyl)-sn-glycero-3-phosphocholine C40H74NO10P 759.5050
LMISGP20019CB3 PC(20:1(13Z)/12:1(10E)(9OH,12OH,12Ke)) 1-(13Z-eicosenoyl)-2-(9-hydroxy-11-carboxy-10E-undecenoyl)-sn-glycero-3-phosphocholine C40H74NO11P 775.5000
LMISGP20019CB4 PC(20:1(13Z)/13:2(9E,11E)(13Ke)) 1-(13Z-eicosenoyl)-2-(13-oxo-9E,11E-tridecedienoyl)-sn-glycero-3-phosphocholine C41H74NO9P 755.5101
LMISGP20019CB5 PC(20:1(13Z)/13:2(9E,11E)(8Ke,13Ke)) 1-(13Z-eicosenoyl)-2-(8,13-dioxo-9E,11E-tridecadienoyl)-sn-glycero-3-phosphocholine C41H72NO10P 769.4894
LMISGP20019CB6 PC(20:1(13Z)/13:2(9E,11E)(8OH,13Ke)) 1-(13Z-eicosenoyl)-2-(8-hydroxy-13-oxo-9E,11E-tridecadienoyl)-sn-glycero-3-phosphocholine C41H74NO10P 771.5050
LMISGP20019CB7 PC(20:1(13Z)/13:3(5Z,8E,11E)(10OH,13Ke)) 1-(13Z-eicosenoyl)-2-(10-hydroxy-13-oxo-5Z,8E,11E-tridecatrienoyl)-sn-glycero-3-phosphocholine C41H72NO10P 769.4894
LMISGP20019CB8 PC(20:1(13Z)/18:2(10E,12Z)(9OH[R])) 1-(13Z-eicosenoyl)-2-(9R-HODE)-sn-glycero-3-phosphocholine C46H86NO9P 827.6040
LMISGP20019CB9 PC(20:1(13Z)/18:2(10E,12Z)(9OH[S])) 1-(13Z-eicosenoyl)-2-(9S-HODE)-sn-glycero-3-phosphocholine C46H86NO9P 827.6040
LMISGP20019CCA PC(20:1(13Z)/18:2(8E,12Z)(10OH[R])) 1-(13Z-eicosenoyl)-2-(10R-HODE)-sn-glycero-3-phosphocholine C46H86NO9P 827.6040
LMISGP20019CCB PC(20:1(13Z)/18:2(8E,12Z)(10OH[S])) 1-(13Z-eicosenoyl)-2-(10S-HODE)-sn-glycero-3-phosphocholine C46H86NO9P 827.6040
LMISGP20019CCC PC(20:1(13Z)/18:2(9Z,11E)(13OH[R])) 1-(13Z-eicosenoyl)-2-(13R-HODE)-sn-glycero-3-phosphocholine C46H86NO9P 827.6040
LMISGP20019CCD PC(20:1(13Z)/18:2(9Z,11E)(13OH[S])) 1-(13Z-eicosenoyl)-2-(13S-HODE)-sn-glycero-3-phosphocholine C46H86NO9P 827.6040
LMISGP20019CCE PC(20:1(13Z)/18:2(9Z,12Z)(8OH[R])) 1-(13Z-eicosenoyl)-2-(8R-HODE)-sn-glycero-3-phosphocholine C46H86NO9P 827.6040
LMISGP20019CCF PC(20:1(13Z)/18:2(9Z,12Z)(8OH[S])) 1-(13Z-eicosenoyl)-2-(8S-HODE)-sn-glycero-3-phosphocholine C46H86NO9P 827.6040
LMISGP20019CCG PC(20:1(13Z)/18:2(9Z,15Z)(12OH[R])) 1-(13Z-eicosenoyl)-2-(12R-HODE)-sn-glycero-3-phosphocholine C46H86NO9P 827.6040
LMISGP20019CCH PC(20:1(13Z)/18:2(9Z,15Z)(12OH[S])) 1-(13Z-eicosenoyl)-2-(12S-HODE)-sn-glycero-3-phosphocholine C46H86NO9P 827.6040
LMISGP20019CCJ PC(20:1(13Z)/20:2(5Z,13E)(11OH[R],9Ke,15OH[S]){8a,12b}) 1-(13Z-eicosenoyl)-2-PGE2-sn-glycero-3-phosphocholine C48H86NO11P 883.5939
LMISGP20019CCK PC(20:1(13Z)/20:2(5Z,13E)(9OH[S],11Ke,15OH[S]){8a,12b}) 1-(13Z-eicosenoyl)-2-PGD2-sn-glycero-3-phosphocholine C48H86NO11P 883.5939
LMISGP20019CCL PC(20:1(13Z)/20:2(7E,14Z)(5Ep,9Ke,11OH){8,12}) 1-(13Z-eicosenoyl)-2-(5,6-epoxy-isoPE2)-sn-glycero-3-phosphocholine C48H84NO11P 881.5782
LMISGP20019CCM PC(20:1(13Z)/20:3(7E,10Z,14Z)(5Ep,9Ke){8,12}) 1-(13Z-eicosenoyl)-2-(5,6-epoxycyclopentenone)-sn-glycero-3-phosphocholine C48H82NO10P 863.5676
LMISGP20019CCN PC(20:1(13Z)/20:4(5Z,7E,11Z,14Z)(9Ke)) 1-(13Z-eicosenoyl)-2-(9-Oxo-ETE)-sn-glycero-3-phosphocholine C48H84NO9P 849.5884
LMISGP20019CCO PC(20:1(13Z)/20:4(5Z,7E,11Z,14Z)(9OH[S])) 1-(13Z-eicosenoyl)-2-(9S-HETE)-sn-glycero-3-phosphocholine C48H86NO9P 851.6040
LMISGP20019CCP PC(20:1(13Z)/20:4(5Z,8Z,10E,14Z)(12Ke)) 1-(13Z-eicosenoyl)-2-(12-Oxo-ETE)-sn-glycero-3-phosphocholine C48H84NO9P 849.5884
LMISGP20019CCQ PC(20:1(13Z)/20:4(5Z,8Z,10E,14Z)(12OH[S])) 1-(13Z-eicosenoyl)-2-(12S-HETE)-sn-glycero-3-phosphocholine C48H86NO9P 851.6040
LMISGP20019CCR PC(20:1(13Z)/20:4(5Z,8Z,11Z,13E)(15Ke)) 1-(13Z-eicosenoyl)-2-(15-Oxo-ETE)-sn-glycero-3-phosphocholine C48H84NO9P 849.5884
LMISGP20019CCS PC(20:1(13Z)/20:4(5Z,8Z,11Z,13E)(15OH[S])) 1-(13Z-eicosenoyl)-2-(15S-HETE)-sn-glycero-3-phosphocholine C48H86NO9P 851.6040
LMISGP20019CCT PC(20:1(13Z)/20:4(5Z,8Z,12E,14Z)(11Ke)) 1-(13Z-eicosenoyl)-2-(11-oxo-ETE)-sn-glycero-3-phosphocholine C48H84NO9P 849.5884
LMISGP20019CCU PC(20:1(13Z)/20:4(5Z,8Z,12E,14Z)(11OH[S])) 1-(13Z-eicosenoyl)-2-(11S-HETE)-sn-glycero-3-phosphocholine C48H86NO9P 851.6040
LMISGP20019CCV PC(20:1(13Z)/20:4(5Z,9E,11Z,14Z)(8Ke)) 1-(13Z-eicosenoyl)-2-(8-Oxo-ETE)-sn-glycero-3-phosphocholine C48H84NO9P 849.5884
LMISGP20019CCW PC(20:1(13Z)/20:4(5Z,9E,11Z,14Z)(8OH[S])) 1-(13Z-eicosenoyl)-2-(8S-HETE)-sn-glycero-3-phosphocholine C48H86NO9P 851.6040
LMISGP20019CCX PC(20:1(13Z)/20:4(6E,8Z,11Z,14Z)(5Ke)) 1-(13Z-eicosenoyl)-2-(5-Oxo-ETE)-sn-glycero-3-phosphocholine C48H84NO9P 849.5884
LMISGP20019CCY PC(20:1(13Z)/20:4(6E,8Z,11Z,14Z)(5OH[S])) 1-(13Z-eicosenoyl)-2-(5S-HETE)-sn-glycero-3-phosphocholine C48H86NO9P 851.6040
LMISGP20019CCZ PC(20:1(13Z)/22:6(4Z,6E,10Z,13Z,16Z,19Z)(8OH)) 1-(13Z-eicosenoyl)-2-(8-HDoHE)-sn-glycero-3-phosphocholine C50H86NO9P 875.6040
LMISGP20019CC0 PC(20:1(13Z)/22:6(4Z,7Z,10Z,12E,16Z,19Z)(14OH)) 1-(13Z-eicosenoyl)-2-(14-HDoHE)-sn-glycero-3-phosphocholine C50H86NO9P 875.6040