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
LMISGP20019FQ4 PC(P-18:1(9Z)/18:2(9Z,11E)(13OH[R])) 1-(1Z,9Z-octadecadienyl)-2-(13R-HODE)-sn-glycero-3-phosphocholine C44H82NO8P 783.5778
LMISGP20019FQ5 PC(P-18:1(9Z)/18:2(9Z,11E)(13OH[S])) 1-(1Z,9Z-octadecadienyl)-2-(13S-HODE)-sn-glycero-3-phosphocholine C44H82NO8P 783.5778
LMISGP20019FQ6 PC(P-18:1(9Z)/18:2(9Z,12Z)(8OH[R])) 1-(1Z,9Z-octadecadienyl)-2-(8R-HODE)-sn-glycero-3-phosphocholine C44H82NO8P 783.5778
LMISGP20019FQ7 PC(P-18:1(9Z)/18:2(9Z,12Z)(8OH[S])) 1-(1Z,9Z-octadecadienyl)-2-(8S-HODE)-sn-glycero-3-phosphocholine C44H82NO8P 783.5778
LMISGP20019FQ8 PC(P-18:1(9Z)/18:2(9Z,15Z)(12OH[R])) 1-(1Z,9Z-octadecadienyl)-2-(12R-HODE)-sn-glycero-3-phosphocholine C44H82NO8P 783.5778
LMISGP20019FQ9 PC(P-18:1(9Z)/18:2(9Z,15Z)(12OH[S])) 1-(1Z,9Z-octadecadienyl)-2-(12S-HODE)-sn-glycero-3-phosphocholine C44H82NO8P 783.5778
LMISGP20019FRB PC(P-18:1(9Z)/20:2(5Z,13E)(11OH[R],9Ke,15OH[S]){8a,12b}) 1-(1Z,9Z-octadecadienyl)-2-PGE2-sn-glycero-3-phosphocholine C46H82NO10P 839.5676
LMISGP20019FRC PC(P-18:1(9Z)/20:2(5Z,13E)(9OH[S],11Ke,15OH[S]){8a,12b}) 1-(1Z,9Z-octadecadienyl)-2-PGD2-sn-glycero-3-phosphocholine C46H82NO10P 839.5676
LMISGP20019FRD PC(P-18:1(9Z)/20:2(7E,14Z)(5Ep,9Ke,11OH){8,12}) 1-(1Z,9Z-octadecadienyl)-2-(5,6-epoxy-isoPE2)-sn-glycero-3-phosphocholine C46H80NO10P 837.5520
LMISGP20019FRE PC(P-18:1(9Z)/20:3(7E,10Z,14Z)(5Ep,9Ke){8,12}) 1-(1Z,9Z-octadecadienyl)-2-(5,6-epoxycyclopentenone)-sn-glycero-3-phosphocholine C46H78NO9P 819.5414
LMISGP20019FRF PC(P-18:1(9Z)/20:4(5Z,7E,11Z,14Z)(9Ke)) 1-(1Z,9Z-octadecadienyl)-2-(9-Oxo-ETE)-sn-glycero-3-phosphocholine C46H80NO8P 805.5622
LMISGP20019FRG PC(P-18:1(9Z)/20:4(5Z,7E,11Z,14Z)(9OH[S])) 1-(1Z,9Z-octadecadienyl)-2-(9S-HETE)-sn-glycero-3-phosphocholine C46H82NO8P 807.5778
LMISGP20019FRH PC(P-18:1(9Z)/20:4(5Z,8Z,10E,14Z)(12Ke)) 1-(1Z,9Z-octadecadienyl)-2-(12-Oxo-ETE)-sn-glycero-3-phosphocholine C46H80NO8P 805.5622
LMISGP20019FRI PC(P-18:1(9Z)/20:4(5Z,8Z,10E,14Z)(12OH[S])) 1-(1Z,9Z-octadecadienyl)-2-(12S-HETE)-sn-glycero-3-phosphocholine C46H82NO8P 807.5778
LMISGP20019FRJ PC(P-18:1(9Z)/20:4(5Z,8Z,11Z,13E)(15Ke)) 1-(1Z,9Z-octadecadienyl)-2-(15-Oxo-ETE)-sn-glycero-3-phosphocholine C46H80NO8P 805.5622
LMISGP20019FRK PC(P-18:1(9Z)/20:4(5Z,8Z,11Z,13E)(15OH[S])) 1-(1Z,9Z-octadecadienyl)-2-(15S-HETE)-sn-glycero-3-phosphocholine C46H82NO8P 807.5778
LMISGP20019FRL PC(P-18:1(9Z)/20:4(5Z,8Z,12E,14Z)(11Ke)) 1-(1Z,9Z-octadecadienyl)-2-(11-oxo-ETE)-sn-glycero-3-phosphocholine C46H80NO8P 805.5622
LMISGP20019FRM PC(P-18:1(9Z)/20:4(5Z,8Z,12E,14Z)(11OH[S])) 1-(1Z,9Z-octadecadienyl)-2-(11S-HETE)-sn-glycero-3-phosphocholine C46H82NO8P 807.5778
LMISGP20019FRN PC(P-18:1(9Z)/20:4(5Z,9E,11Z,14Z)(8Ke)) 1-(1Z,9Z-octadecadienyl)-2-(8-Oxo-ETE)-sn-glycero-3-phosphocholine C46H80NO8P 805.5622
LMISGP20019FRO PC(P-18:1(9Z)/20:4(5Z,9E,11Z,14Z)(8OH[S])) 1-(1Z,9Z-octadecadienyl)-2-(8S-HETE)-sn-glycero-3-phosphocholine C46H82NO8P 807.5778
LMISGP20019FRP PC(P-18:1(9Z)/20:4(6E,8Z,11Z,14Z)(5Ke)) 1-(1Z,9Z-octadecadienyl)-2-(5-Oxo-ETE)-sn-glycero-3-phosphocholine C46H80NO8P 805.5622
LMISGP20019FRQ PC(P-18:1(9Z)/20:4(6E,8Z,11Z,14Z)(5OH[S])) 1-(1Z,9Z-octadecadienyl)-2-(5S-HETE)-sn-glycero-3-phosphocholine C46H82NO8P 807.5778
LMISGP20019FRR PC(P-18:1(9Z)/22:6(4Z,6E,10Z,13Z,16Z,19Z)(8OH)) 1-(1Z,9Z-octadecadienyl)-2-(8-HDoHE)-sn-glycero-3-phosphocholine C48H82NO8P 831.5778
LMISGP20019FRS PC(P-18:1(9Z)/22:6(4Z,7Z,10Z,12E,16Z,19Z)(14OH)) 1-(1Z,9Z-octadecadienyl)-2-(14-HDoHE)-sn-glycero-3-phosphocholine C48H82NO8P 831.5778
LMISGP20019FRT PC(P-18:1(9Z)/22:6(4Z,7Z,10Z,13Z,15E,19Z)(17OH)) 1-(1Z,9Z-octadecadienyl)-2-(17-HDoHE)-sn-glycero-3-phosphocholine C48H82NO8P 831.5778
LMISGP20019FRU PC(P-18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,18E)(20OH)) 1-(1Z,9Z-octadecadienyl)-2-(20-HDoHE)-sn-glycero-3-phosphocholine C48H82NO8P 831.5778
LMISGP20019FRV PC(P-18:1(9Z)/22:6(4Z,7Z,10Z,13Z,17E,19Z)(16OH)) 1-(1Z,9Z-octadecadienyl)-2-(16-HDoHE)-sn-glycero-3-phosphocholine C48H82NO8P 831.5778
LMISGP20019FRW PC(P-18:1(9Z)/22:6(4Z,7Z,10Z,14E,16Z,19Z)(13OH)) 1-(1Z,9Z-octadecadienyl)-2-(13-HDoHE)-sn-glycero-3-phosphocholine C48H82NO8P 831.5778
LMISGP20019FRX PC(P-18:1(9Z)/22:6(4Z,7Z,11E,13Z,16Z,19Z)(10OH)) 1-(1Z,9Z-octadecadienyl)-2-(10-HDoHE)-sn-glycero-3-phosphocholine C48H82NO8P 831.5778
LMISGP20019FRY PC(P-18:1(9Z)/22:6(4Z,7Z,9E,13Z,16Z,19Z)(11OH)) 1-(1Z,9Z-octadecadienyl)-2-(11-HDoHE)-sn-glycero-3-phosphocholine C48H82NO8P 831.5778
LMISGP20019FRZ PC(P-18:1(9Z)/22:6(4Z,8E,10Z,13Z,16Z,19Z)(7OH)) 1-(1Z,9Z-octadecadienyl)-2-(7-HDoHE)-sn-glycero-3-phosphocholine C48H82NO8P 831.5778
LMISGP20019FR0 PC(P-18:1(9Z)/22:6(5E,7Z,10Z,13Z,16Z,19Z)(4OH)) 1-(1Z,9Z-octadecadienyl)-2-(4-HDoHE)-sn-glycero-3-phosphocholine C48H82NO8P 831.5778
LMISGP20019FS6 PC(P-20:0/2:0) 1-(1Z-eicosenyl)-2-acetyl-sn-glycero-3-phosphocholine C30H60NO7P 577.4107
LMISGP20019FTZ PC(P-20:0/4:0) 1-(1Z-eicosenyl)-2-butyryl-sn-glycero-3-phosphocholine C32H64NO7P 605.4420
LMISGP20019FT0 PC(P-20:0/4:1(3E)) 1-(1Z-eicosenyl)-2-3E-butenoyl-sn-glycero-3-phosphocholine C32H62NO7P 603.4264
LMISGP20019FTX PC(P-20:0/4:0(4Ke)) 1-(1Z-eicosenyl)-2-(4-oxobutyryl)-sn-glycero-3-phosphocholine C32H62NO8P 619.4213
LMISGP20019FTY PC(P-20:0/4:0(4OH,4Ke)) 1-(1Z-eicosenyl)-2-succinyl-sn-glycero-3-phosphocholine C32H62NO9P 635.4162
LMISGP20019FT1 PC(P-20:0/5:0(5Ke)) 1-(1Z-eicosenyl)-2-(5-oxo-valeroyl)-sn-glycero-3-phosphocholine C33H64NO8P 633.4370
LMISGP20019FT2 PC(P-20:0/5:0(5OH,5Ke)) 1-(1Z-eicosenyl)-2-glutaroyl-sn-glycero-3-phosphocholine C33H64NO9P 649.4319
LMISGP20019FT3 PC(P-20:0/6:1(4E)(3Ke,6OH,6Ke)) 1-(1Z-eicosenyl)-2-(3,6-dioxo-4E-hexenoyl)-sn-glycero-3-phosphocholine C34H62NO10P 675.4111
LMISGP20019FT4 PC(P-20:0/6:1(4E)(6Ke)) 1-(1Z-eicosenyl)-2-(6-oxo-4E-hexenoyl)-sn-glycero-3-phosphocholine C34H64NO8P 645.4370
LMISGP20019FT5 PC(P-20:0/7:1(5E)(4Ke,7Ke)) 1-(1Z-eicosenyl)-2-(4,7-dioxo-5E-heptenoyl)-sn-glycero-3-phosphocholine C35H64NO9P 673.4319
LMISGP20019FT6 PC(P-20:0/7:1(5E)(4Ke,7OH,7Ke)) 1-(1Z-eicosenyl)-2-(4-keto-6-carboxy-5E-hexenoyl)-sn-glycero-3-phosphocholine C35H64NO10P 689.4268
LMISGP20019FT7 PC(P-20:0/7:1(5E)(4OH,7Ke)) 1-(1Z-eicosenyl)-2-(4-hydroxy-7-oxo-5E-heptenoyl)-sn-glycero-3-phosphocholine C35H66NO9P 675.4475
LMISGP20019FT8 PC(P-20:0/7:1(5E)(4OH,7OH,7Ke)) 1-(1Z-eicosenyl)-2-(4-hydroxy-6-carboxy-5E-hexenoyl)-sn-glycero-3-phosphocholine C35H66NO10P 691.4424
LMISGP20019FT9 PC(P-20:0/8:0(8Ke)) 1-(1Z-eicosenyl)-2-(8-Oxo-octanoyl)-sn-glycero-3-phosphocholine C36H70NO8P 675.4839
LMISGP20019FUA PC(P-20:0/8:0(8OH,8Ke)) 1-(1Z-eicosenyl)-2-(8-Carboxy-heptanoyl)-sn-glycero-3-phosphocholine C36H70NO9P 691.4788
LMISGP20019FUB PC(P-20:0/8:1(6E)(5Ke,8Ke)) 1-(1Z-eicosenyl)-2-(5,8-dioxo-6E-octenoyl)-sn-glycero-3-phosphocholine C36H66NO9P 687.4475
LMISGP20019FUC PC(P-20:0/8:1(6E)(5Ke,8OH,8Ke)) 1-(1Z-eicosenyl)-2-(5-keto-7-carboxy-6E-heptenoyl)-sn-glycero-3-phosphocholine C36H66NO10P 703.4424
LMISGP20019FUD PC(P-20:0/8:1(6E)(5OH,8Ke)) 1-(1Z-eicosenyl)-2-(5-hydroxy-8-oxo-6E-octenoyl)-sn-glycero-3-phosphocholine C36H68NO9P 689.4632