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
LMISGP20019BWT PC(18:3(6Z,9Z,12Z)/9:2(5E,7E)(4Ke,9Ke)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(4,9-dioxo-5E,7E-nonadienoyl)-sn-glycero-3-phosphocholine C35H56NO10P 681.3642
LMISGP20019BUY PC(18:3(6Z,9Z,12Z)/11:1(9E)(11Ke)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(11-Oxo-9E-undecenoyl)-sn-glycero-3-phosphocholine C37H64NO9P 697.4319
LMISGP20019BUZ PC(18:3(6Z,9Z,12Z)/11:2(6E,8E)(5OH,10OH,11Ke)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(5,10-Dihydroxy-11-oxo-6E,8E-undecadienoyl)-sn-glycero-3-phosphocholine C37H62NO11P 727.4061
LMISGP20019BU0 PC(18:3(6Z,9Z,12Z)/12:0(9Ke,12Ke)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(9,12-dioxodecanoyl)-sn-glycero-3-phosphocholine C38H66NO10P 727.4424
LMISGP20019BU1 PC(18:3(6Z,9Z,12Z)/12:1(10E)(9Ke,12OH,12Ke)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(9-oxo-11-carboxy-10E-undecenoyl)-sn-glycero-3-phosphocholine C38H64NO11P 741.4217
LMISGP20019BU2 PC(18:3(6Z,9Z,12Z)/12:1(10E)(9OH,12Ke)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(9-hydroxy-12-oxo-10E-dodecenoyl)-sn-glycero-3-phosphocholine C38H66NO10P 727.4424
LMISGP20019BU3 PC(18:3(6Z,9Z,12Z)/12:1(10E)(9OH,12OH,12Ke)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(9-hydroxy-11-carboxy-10E-undecenoyl)-sn-glycero-3-phosphocholine C38H66NO11P 743.4374
LMISGP20019BU4 PC(18:3(6Z,9Z,12Z)/13:2(9E,11E)(13Ke)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(13-oxo-9E,11E-tridecedienoyl)-sn-glycero-3-phosphocholine C39H66NO9P 723.4475
LMISGP20019BU5 PC(18:3(6Z,9Z,12Z)/13:2(9E,11E)(8Ke,13Ke)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(8,13-dioxo-9E,11E-tridecadienoyl)-sn-glycero-3-phosphocholine C39H64NO10P 737.4268
LMISGP20019BU6 PC(18:3(6Z,9Z,12Z)/13:2(9E,11E)(8OH,13Ke)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(8-hydroxy-13-oxo-9E,11E-tridecadienoyl)-sn-glycero-3-phosphocholine C39H66NO10P 739.4424
LMISGP20019BU7 PC(18:3(6Z,9Z,12Z)/13:3(5Z,8E,11E)(10OH,13Ke)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(10-hydroxy-13-oxo-5Z,8E,11E-tridecatrienoyl)-sn-glycero-3-phosphocholine C39H64NO10P 737.4268
LMISGP20019BU8 PC(18:3(6Z,9Z,12Z)/18:2(10E,12Z)(9OH[R])) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(9R-HODE)-sn-glycero-3-phosphocholine C44H78NO9P 795.5414
LMISGP20019BU9 PC(18:3(6Z,9Z,12Z)/18:2(10E,12Z)(9OH[S])) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(9S-HODE)-sn-glycero-3-phosphocholine C44H78NO9P 795.5414
LMISGP20019BVA PC(18:3(6Z,9Z,12Z)/18:2(8E,12Z)(10OH[R])) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(10R-HODE)-sn-glycero-3-phosphocholine C44H78NO9P 795.5414
LMISGP20019BVB PC(18:3(6Z,9Z,12Z)/18:2(8E,12Z)(10OH[S])) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(10S-HODE)-sn-glycero-3-phosphocholine C44H78NO9P 795.5414
LMISGP20019BVC PC(18:3(6Z,9Z,12Z)/18:2(9Z,11E)(13OH[R])) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(13R-HODE)-sn-glycero-3-phosphocholine C44H78NO9P 795.5414
LMISGP20019BVD PC(18:3(6Z,9Z,12Z)/18:2(9Z,11E)(13OH[S])) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(13S-HODE)-sn-glycero-3-phosphocholine C44H78NO9P 795.5414
LMISGP20019BVE PC(18:3(6Z,9Z,12Z)/18:2(9Z,12Z)(8OH[R])) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(8R-HODE)-sn-glycero-3-phosphocholine C44H78NO9P 795.5414
LMISGP20019BVF PC(18:3(6Z,9Z,12Z)/18:2(9Z,12Z)(8OH[S])) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(8S-HODE)-sn-glycero-3-phosphocholine C44H78NO9P 795.5414
LMISGP20019BVG PC(18:3(6Z,9Z,12Z)/18:2(9Z,15Z)(12OH[R])) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(12R-HODE)-sn-glycero-3-phosphocholine C44H78NO9P 795.5414
LMISGP20019BVH PC(18:3(6Z,9Z,12Z)/18:2(9Z,15Z)(12OH[S])) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(12S-HODE)-sn-glycero-3-phosphocholine C44H78NO9P 795.5414
LMISGP20019BVJ PC(18:3(6Z,9Z,12Z)/20:2(5Z,13E)(11OH[R],9Ke,15OH[S]){8a,12b}) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-PGE2-sn-glycero-3-phosphocholine C46H78NO11P 851.5313
LMISGP20019BVK PC(18:3(6Z,9Z,12Z)/20:2(5Z,13E)(9OH[S],11Ke,15OH[S]){8a,12b}) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-PGD2-sn-glycero-3-phosphocholine C46H78NO11P 851.5313
LMISGP20019BVL PC(18:3(6Z,9Z,12Z)/20:2(7E,14Z)(5Ep,9Ke,11OH){8,12}) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(5,6-epoxy-isoPE2)-sn-glycero-3-phosphocholine C46H76NO11P 849.5156
LMISGP20019BVM PC(18:3(6Z,9Z,12Z)/20:3(7E,10Z,14Z)(5Ep,9Ke){8,12}) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(5,6-epoxycyclopentenone)-sn-glycero-3-phosphocholine C46H74NO10P 831.5050
LMISGP20019BVN PC(18:3(6Z,9Z,12Z)/20:4(5Z,7E,11Z,14Z)(9Ke)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(9-Oxo-ETE)-sn-glycero-3-phosphocholine C46H76NO9P 817.5258
LMISGP20019BVO PC(18:3(6Z,9Z,12Z)/20:4(5Z,7E,11Z,14Z)(9OH[S])) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(9S-HETE)-sn-glycero-3-phosphocholine C46H78NO9P 819.5414
LMISGP20019BVP PC(18:3(6Z,9Z,12Z)/20:4(5Z,8Z,10E,14Z)(12Ke)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(12-Oxo-ETE)-sn-glycero-3-phosphocholine C46H76NO9P 817.5258
LMISGP20019BVQ PC(18:3(6Z,9Z,12Z)/20:4(5Z,8Z,10E,14Z)(12OH[S])) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(12S-HETE)-sn-glycero-3-phosphocholine C46H78NO9P 819.5414
LMISGP20019BVR PC(18:3(6Z,9Z,12Z)/20:4(5Z,8Z,11Z,13E)(15Ke)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(15-Oxo-ETE)-sn-glycero-3-phosphocholine C46H76NO9P 817.5258
LMISGP20019BVS PC(18:3(6Z,9Z,12Z)/20:4(5Z,8Z,11Z,13E)(15OH[S])) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(15S-HETE)-sn-glycero-3-phosphocholine C46H78NO9P 819.5414
LMISGP20019BVT PC(18:3(6Z,9Z,12Z)/20:4(5Z,8Z,12E,14Z)(11Ke)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(11-oxo-ETE)-sn-glycero-3-phosphocholine C46H76NO9P 817.5258
LMISGP20019BVU PC(18:3(6Z,9Z,12Z)/20:4(5Z,8Z,12E,14Z)(11OH[S])) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(11S-HETE)-sn-glycero-3-phosphocholine C46H78NO9P 819.5414
LMISGP20019BVV PC(18:3(6Z,9Z,12Z)/20:4(5Z,9E,11Z,14Z)(8Ke)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(8-Oxo-ETE)-sn-glycero-3-phosphocholine C46H76NO9P 817.5258
LMISGP20019BVW PC(18:3(6Z,9Z,12Z)/20:4(5Z,9E,11Z,14Z)(8OH[S])) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(8S-HETE)-sn-glycero-3-phosphocholine C46H78NO9P 819.5414
LMISGP20019BVX PC(18:3(6Z,9Z,12Z)/20:4(6E,8Z,11Z,14Z)(5Ke)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(5-Oxo-ETE)-sn-glycero-3-phosphocholine C46H76NO9P 817.5258
LMISGP20019BVY PC(18:3(6Z,9Z,12Z)/20:4(6E,8Z,11Z,14Z)(5OH[S])) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(5S-HETE)-sn-glycero-3-phosphocholine C46H78NO9P 819.5414
LMISGP20019BVZ PC(18:3(6Z,9Z,12Z)/22:6(4Z,6E,10Z,13Z,16Z,19Z)(8OH)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(8-HDoHE)-sn-glycero-3-phosphocholine C48H78NO9P 843.5414
LMISGP20019BV0 PC(18:3(6Z,9Z,12Z)/22:6(4Z,7Z,10Z,12E,16Z,19Z)(14OH)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(14-HDoHE)-sn-glycero-3-phosphocholine C48H78NO9P 843.5414
LMISGP20019BV1 PC(18:3(6Z,9Z,12Z)/22:6(4Z,7Z,10Z,13Z,15E,19Z)(17OH)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(17-HDoHE)-sn-glycero-3-phosphocholine C48H78NO9P 843.5414
LMISGP20019BV2 PC(18:3(6Z,9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,18E)(20OH)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(20-HDoHE)-sn-glycero-3-phosphocholine C48H78NO9P 843.5414
LMISGP20019BV3 PC(18:3(6Z,9Z,12Z)/22:6(4Z,7Z,10Z,13Z,17E,19Z)(16OH)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(16-HDoHE)-sn-glycero-3-phosphocholine C48H78NO9P 843.5414
LMISGP20019BV4 PC(18:3(6Z,9Z,12Z)/22:6(4Z,7Z,10Z,14E,16Z,19Z)(13OH)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(13-HDoHE)-sn-glycero-3-phosphocholine C48H78NO9P 843.5414
LMISGP20019BV5 PC(18:3(6Z,9Z,12Z)/22:6(4Z,7Z,11E,13Z,16Z,19Z)(10OH)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(10-HDoHE)-sn-glycero-3-phosphocholine C48H78NO9P 843.5414
LMISGP20019BV6 PC(18:3(6Z,9Z,12Z)/22:6(4Z,7Z,9E,13Z,16Z,19Z)(11OH)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(11-HDoHE)-sn-glycero-3-phosphocholine C48H78NO9P 843.5414
LMISGP20019BV7 PC(18:3(6Z,9Z,12Z)/22:6(4Z,8E,10Z,13Z,16Z,19Z)(7OH)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(7-HDoHE)-sn-glycero-3-phosphocholine C48H78NO9P 843.5414
LMISGP20019BV8 PC(18:3(6Z,9Z,12Z)/22:6(5E,7Z,10Z,13Z,16Z,19Z)(4OH)) 1-(6Z,9Z,12Z-octadecatrienoyl)-2-(4-HDoHE)-sn-glycero-3-phosphocholine C48H78NO9P 843.5414
LMISGP20019BXE PC(18:3(9Z,12Z,15Z)/2:0) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-acetyl-sn-glycero-3-phosphocholine C28H50NO8P 559.3274
LMISGP20019BX7 PC(18:3(9Z,12Z,15Z)/4:0) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-butyryl-sn-glycero-3-phosphocholine C30H54NO8P 587.3587
LMISGP20019BX8 PC(18:3(9Z,12Z,15Z)/4:1(3E)) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-3E-butenoyl-sn-glycero-3-phosphocholine C30H52NO8P 585.3431