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
LMISGP20019AYV PC(17:2(9Z,12Z)/11:2(6E,8E)(5OH,10OH,11Ke)) 1-(9Z,12Z-heptadecadienoyl)-2-(5,10-Dihydroxy-11-oxo-6E,8E-undecadienoyl)-sn-glycero-3-phosphocholine C36H62NO11P 715.4061
LMISGP20019AYW PC(17:2(9Z,12Z)/12:0(9Ke,12Ke)) 1-(9Z,12Z-heptadecadienoyl)-2-(9,12-dioxodecanoyl)-sn-glycero-3-phosphocholine C37H66NO10P 715.4424
LMISGP20019AYX PC(17:2(9Z,12Z)/12:1(10E)(9Ke,12OH,12Ke)) 1-(9Z,12Z-heptadecadienoyl)-2-(9-oxo-11-carboxy-10E-undecenoyl)-sn-glycero-3-phosphocholine C37H64NO11P 729.4217
LMISGP20019AYY PC(17:2(9Z,12Z)/12:1(10E)(9OH,12Ke)) 1-(9Z,12Z-heptadecadienoyl)-2-(9-hydroxy-12-oxo-10E-dodecenoyl)-sn-glycero-3-phosphocholine C37H66NO10P 715.4424
LMISGP20019AYZ PC(17:2(9Z,12Z)/12:1(10E)(9OH,12OH,12Ke)) 1-(9Z,12Z-heptadecadienoyl)-2-(9-hydroxy-11-carboxy-10E-undecenoyl)-sn-glycero-3-phosphocholine C37H66NO11P 731.4374
LMISGP20019AY0 PC(17:2(9Z,12Z)/13:2(9E,11E)(13Ke)) 1-(9Z,12Z-heptadecadienoyl)-2-(13-oxo-9E,11E-tridecedienoyl)-sn-glycero-3-phosphocholine C38H66NO9P 711.4475
LMISGP20019AY1 PC(17:2(9Z,12Z)/13:2(9E,11E)(8Ke,13Ke)) 1-(9Z,12Z-heptadecadienoyl)-2-(8,13-dioxo-9E,11E-tridecadienoyl)-sn-glycero-3-phosphocholine C38H64NO10P 725.4268
LMISGP20019AY2 PC(17:2(9Z,12Z)/13:2(9E,11E)(8OH,13Ke)) 1-(9Z,12Z-heptadecadienoyl)-2-(8-hydroxy-13-oxo-9E,11E-tridecadienoyl)-sn-glycero-3-phosphocholine C38H66NO10P 727.4424
LMISGP20019AY3 PC(17:2(9Z,12Z)/13:3(5Z,8E,11E)(10OH,13Ke)) 1-(9Z,12Z-heptadecadienoyl)-2-(10-hydroxy-13-oxo-5Z,8E,11E-tridecatrienoyl)-sn-glycero-3-phosphocholine C38H64NO10P 725.4268
LMISGP20019AY4 PC(17:2(9Z,12Z)/18:2(10E,12Z)(9OH[R])) 1-(9Z,12Z-heptadecadienoyl)-2-(9R-HODE)-sn-glycero-3-phosphocholine C43H78NO9P 783.5414
LMISGP20019AY5 PC(17:2(9Z,12Z)/18:2(10E,12Z)(9OH[S])) 1-(9Z,12Z-heptadecadienoyl)-2-(9S-HODE)-sn-glycero-3-phosphocholine C43H78NO9P 783.5414
LMISGP20019AY6 PC(17:2(9Z,12Z)/18:2(8E,12Z)(10OH[R])) 1-(9Z,12Z-heptadecadienoyl)-2-(10R-HODE)-sn-glycero-3-phosphocholine C43H78NO9P 783.5414
LMISGP20019AY7 PC(17:2(9Z,12Z)/18:2(8E,12Z)(10OH[S])) 1-(9Z,12Z-heptadecadienoyl)-2-(10S-HODE)-sn-glycero-3-phosphocholine C43H78NO9P 783.5414
LMISGP20019AY8 PC(17:2(9Z,12Z)/18:2(9Z,11E)(13OH[R])) 1-(9Z,12Z-heptadecadienoyl)-2-(13R-HODE)-sn-glycero-3-phosphocholine C43H78NO9P 783.5414
LMISGP20019AY9 PC(17:2(9Z,12Z)/18:2(9Z,11E)(13OH[S])) 1-(9Z,12Z-heptadecadienoyl)-2-(13S-HODE)-sn-glycero-3-phosphocholine C43H78NO9P 783.5414
LMISGP20019AZA PC(17:2(9Z,12Z)/18:2(9Z,12Z)(8OH[R])) 1-(9Z,12Z-heptadecadienoyl)-2-(8R-HODE)-sn-glycero-3-phosphocholine C43H78NO9P 783.5414
LMISGP20019AZB PC(17:2(9Z,12Z)/18:2(9Z,12Z)(8OH[S])) 1-(9Z,12Z-heptadecadienoyl)-2-(8S-HODE)-sn-glycero-3-phosphocholine C43H78NO9P 783.5414
LMISGP20019AZC PC(17:2(9Z,12Z)/18:2(9Z,15Z)(12OH[R])) 1-(9Z,12Z-heptadecadienoyl)-2-(12R-HODE)-sn-glycero-3-phosphocholine C43H78NO9P 783.5414
LMISGP20019AZD PC(17:2(9Z,12Z)/18:2(9Z,15Z)(12OH[S])) 1-(9Z,12Z-heptadecadienoyl)-2-(12S-HODE)-sn-glycero-3-phosphocholine C43H78NO9P 783.5414
LMISGP20019AZF PC(17:2(9Z,12Z)/20:2(5Z,13E)(11OH[R],9Ke,15OH[S]){8a,12b}) 1-(9Z,12Z-heptadecadienoyl)-2-PGE2-sn-glycero-3-phosphocholine C45H78NO11P 839.5313
LMISGP20019AZG PC(17:2(9Z,12Z)/20:2(5Z,13E)(9OH[S],11Ke,15OH[S]){8a,12b}) 1-(9Z,12Z-heptadecadienoyl)-2-PGD2-sn-glycero-3-phosphocholine C45H78NO11P 839.5313
LMISGP20019AZH PC(17:2(9Z,12Z)/20:2(7E,14Z)(5Ep,9Ke,11OH){8,12}) 1-(9Z,12Z-heptadecadienoyl)-2-(5,6-epoxy-isoPE2)-sn-glycero-3-phosphocholine C45H76NO11P 837.5156
LMISGP20019AZI PC(17:2(9Z,12Z)/20:3(7E,10Z,14Z)(5Ep,9Ke){8,12}) 1-(9Z,12Z-heptadecadienoyl)-2-(5,6-epoxycyclopentenone)-sn-glycero-3-phosphocholine C45H74NO10P 819.5050
LMISGP20019AZJ PC(17:2(9Z,12Z)/20:4(5Z,7E,11Z,14Z)(9Ke)) 1-(9Z,12Z-heptadecadienoyl)-2-(9-Oxo-ETE)-sn-glycero-3-phosphocholine C45H76NO9P 805.5258
LMISGP20019AZK PC(17:2(9Z,12Z)/20:4(5Z,7E,11Z,14Z)(9OH[S])) 1-(9Z,12Z-heptadecadienoyl)-2-(9S-HETE)-sn-glycero-3-phosphocholine C45H78NO9P 807.5414
LMISGP20019AZL PC(17:2(9Z,12Z)/20:4(5Z,8Z,10E,14Z)(12Ke)) 1-(9Z,12Z-heptadecadienoyl)-2-(12-Oxo-ETE)-sn-glycero-3-phosphocholine C45H76NO9P 805.5258
LMISGP20019AZM PC(17:2(9Z,12Z)/20:4(5Z,8Z,10E,14Z)(12OH[S])) 1-(9Z,12Z-heptadecadienoyl)-2-(12S-HETE)-sn-glycero-3-phosphocholine C45H78NO9P 807.5414
LMISGP20019AZN PC(17:2(9Z,12Z)/20:4(5Z,8Z,11Z,13E)(15Ke)) 1-(9Z,12Z-heptadecadienoyl)-2-(15-Oxo-ETE)-sn-glycero-3-phosphocholine C45H76NO9P 805.5258
LMISGP20019AZO PC(17:2(9Z,12Z)/20:4(5Z,8Z,11Z,13E)(15OH[S])) 1-(9Z,12Z-heptadecadienoyl)-2-(15S-HETE)-sn-glycero-3-phosphocholine C45H78NO9P 807.5414
LMISGP20019AZP PC(17:2(9Z,12Z)/20:4(5Z,8Z,12E,14Z)(11Ke)) 1-(9Z,12Z-heptadecadienoyl)-2-(11-oxo-ETE)-sn-glycero-3-phosphocholine C45H76NO9P 805.5258
LMISGP20019AZQ PC(17:2(9Z,12Z)/20:4(5Z,8Z,12E,14Z)(11OH[S])) 1-(9Z,12Z-heptadecadienoyl)-2-(11S-HETE)-sn-glycero-3-phosphocholine C45H78NO9P 807.5414
LMISGP20019AZR PC(17:2(9Z,12Z)/20:4(5Z,9E,11Z,14Z)(8Ke)) 1-(9Z,12Z-heptadecadienoyl)-2-(8-Oxo-ETE)-sn-glycero-3-phosphocholine C45H76NO9P 805.5258
LMISGP20019AZS PC(17:2(9Z,12Z)/20:4(5Z,9E,11Z,14Z)(8OH[S])) 1-(9Z,12Z-heptadecadienoyl)-2-(8S-HETE)-sn-glycero-3-phosphocholine C45H78NO9P 807.5414
LMISGP20019AZT PC(17:2(9Z,12Z)/20:4(6E,8Z,11Z,14Z)(5Ke)) 1-(9Z,12Z-heptadecadienoyl)-2-(5-Oxo-ETE)-sn-glycero-3-phosphocholine C45H76NO9P 805.5258
LMISGP20019AZU PC(17:2(9Z,12Z)/20:4(6E,8Z,11Z,14Z)(5OH[S])) 1-(9Z,12Z-heptadecadienoyl)-2-(5S-HETE)-sn-glycero-3-phosphocholine C45H78NO9P 807.5414
LMISGP20019AZV PC(17:2(9Z,12Z)/22:6(4Z,6E,10Z,13Z,16Z,19Z)(8OH)) 1-(9Z,12Z-heptadecadienoyl)-2-(8-HDoHE)-sn-glycero-3-phosphocholine C47H78NO9P 831.5414
LMISGP20019AZW PC(17:2(9Z,12Z)/22:6(4Z,7Z,10Z,12E,16Z,19Z)(14OH)) 1-(9Z,12Z-heptadecadienoyl)-2-(14-HDoHE)-sn-glycero-3-phosphocholine C47H78NO9P 831.5414
LMISGP20019AZX PC(17:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,15E,19Z)(17OH)) 1-(9Z,12Z-heptadecadienoyl)-2-(17-HDoHE)-sn-glycero-3-phosphocholine C47H78NO9P 831.5414
LMISGP20019AZY PC(17:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,18E)(20OH)) 1-(9Z,12Z-heptadecadienoyl)-2-(20-HDoHE)-sn-glycero-3-phosphocholine C47H78NO9P 831.5414
LMISGP20019AZZ PC(17:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,17E,19Z)(16OH)) 1-(9Z,12Z-heptadecadienoyl)-2-(16-HDoHE)-sn-glycero-3-phosphocholine C47H78NO9P 831.5414
LMISGP20019AZ0 PC(17:2(9Z,12Z)/22:6(4Z,7Z,10Z,14E,16Z,19Z)(13OH)) 1-(9Z,12Z-heptadecadienoyl)-2-(13-HDoHE)-sn-glycero-3-phosphocholine C47H78NO9P 831.5414
LMISGP20019AZ1 PC(17:2(9Z,12Z)/22:6(4Z,7Z,11E,13Z,16Z,19Z)(10OH)) 1-(9Z,12Z-heptadecadienoyl)-2-(10-HDoHE)-sn-glycero-3-phosphocholine C47H78NO9P 831.5414
LMISGP20019AZ2 PC(17:2(9Z,12Z)/22:6(4Z,7Z,9E,13Z,16Z,19Z)(11OH)) 1-(9Z,12Z-heptadecadienoyl)-2-(11-HDoHE)-sn-glycero-3-phosphocholine C47H78NO9P 831.5414
LMISGP20019AZ3 PC(17:2(9Z,12Z)/22:6(4Z,8E,10Z,13Z,16Z,19Z)(7OH)) 1-(9Z,12Z-heptadecadienoyl)-2-(7-HDoHE)-sn-glycero-3-phosphocholine C47H78NO9P 831.5414
LMISGP20019AZ4 PC(17:2(9Z,12Z)/22:6(5E,7Z,10Z,13Z,16Z,19Z)(4OH)) 1-(9Z,12Z-heptadecadienoyl)-2-(4-HDoHE)-sn-glycero-3-phosphocholine C47H78NO9P 831.5414
LMISGP20019A13 PC(18:0/4:0) 1-octadecanoyl-2-butyryl-sn-glycero-3-phosphocholine C30H60NO8P 593.4057
LMISGP20019A14 PC(18:0/4:1(3E)) 1-octadecanoyl-2-3E-butenoyl-sn-glycero-3-phosphocholine C30H58NO8P 591.3900
LMISGP20019A11 PC(18:0/4:0(4Ke)) 1-octadecanoyl-2-(4-oxobutyryl)-sn-glycero-3-phosphocholine C30H58NO9P 607.3849
LMISGP20019A12 PC(18:0/4:0(4OH,4Ke)) 1-octadecanoyl-2-succinyl-sn-glycero-3-phosphocholine C30H58NO10P 623.3798
LMISGP20019A15 PC(18:0/5:0(5Ke)) 1-octadecanoyl-2-(5-oxo-valeroyl)-sn-glycero-3-phosphocholine C31H60NO9P 621.4006