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
LMISGP20019FP6 PC(P-18:1(11Z)/4:0(4OH,4Ke)) 1-(1Z,11Z-octadecadienyl)-2-succinyl-sn-glycero-3-phosphocholine C30H56NO9P 605.3693
LMISGP20019FP9 PC(P-18:1(11Z)/5:0(5Ke)) 1-(1Z,11Z-octadecadienyl)-2-(5-oxo-valeroyl)-sn-glycero-3-phosphocholine C31H58NO8P 603.3900
LMISGP20019FQA PC(P-18:1(11Z)/5:0(5OH,5Ke)) 1-(1Z,11Z-octadecadienyl)-2-glutaroyl-sn-glycero-3-phosphocholine C31H58NO9P 619.3849
LMISGP20019FQB PC(P-18:1(11Z)/6:1(4E)(3Ke,6OH,6Ke)) 1-(1Z,11Z-octadecadienyl)-2-(3,6-dioxo-4E-hexenoyl)-sn-glycero-3-phosphocholine C32H56NO10P 645.3642
LMISGP20019FQC PC(P-18:1(11Z)/6:1(4E)(6Ke)) 1-(1Z,11Z-octadecadienyl)-2-(6-oxo-4E-hexenoyl)-sn-glycero-3-phosphocholine C32H58NO8P 615.3900
LMISGP20019FQD PC(P-18:1(11Z)/7:1(5E)(4Ke,7Ke)) 1-(1Z,11Z-octadecadienyl)-2-(4,7-dioxo-5E-heptenoyl)-sn-glycero-3-phosphocholine C33H58NO9P 643.3849
LMISGP20019FQE PC(P-18:1(11Z)/7:1(5E)(4Ke,7OH,7Ke)) 1-(1Z,11Z-octadecadienyl)-2-(4-keto-6-carboxy-5E-hexenoyl)-sn-glycero-3-phosphocholine C33H58NO10P 659.3798
LMISGP20019FQF PC(P-18:1(11Z)/7:1(5E)(4OH,7Ke)) 1-(1Z,11Z-octadecadienyl)-2-(4-hydroxy-7-oxo-5E-heptenoyl)-sn-glycero-3-phosphocholine C33H60NO9P 645.4006
LMISGP20019FQG PC(P-18:1(11Z)/7:1(5E)(4OH,7OH,7Ke)) 1-(1Z,11Z-octadecadienyl)-2-(4-hydroxy-6-carboxy-5E-hexenoyl)-sn-glycero-3-phosphocholine C33H60NO10P 661.3955
LMISGP20019FQH PC(P-18:1(11Z)/8:0(8Ke)) 1-(1Z,11Z-octadecadienyl)-2-(8-Oxo-octanoyl)-sn-glycero-3-phosphocholine C34H64NO8P 645.4370
LMISGP20019FQI PC(P-18:1(11Z)/8:0(8OH,8Ke)) 1-(1Z,11Z-octadecadienyl)-2-(8-Carboxy-heptanoyl)-sn-glycero-3-phosphocholine C34H64NO9P 661.4319
LMISGP20019FQJ PC(P-18:1(11Z)/8:1(6E)(5Ke,8Ke)) 1-(1Z,11Z-octadecadienyl)-2-(5,8-dioxo-6E-octenoyl)-sn-glycero-3-phosphocholine C34H60NO9P 657.4006
LMISGP20019FQK PC(P-18:1(11Z)/8:1(6E)(5Ke,8OH,8Ke)) 1-(1Z,11Z-octadecadienyl)-2-(5-keto-7-carboxy-6E-heptenoyl)-sn-glycero-3-phosphocholine C34H60NO10P 673.3955
LMISGP20019FQL PC(P-18:1(11Z)/8:1(6E)(5OH,8Ke)) 1-(1Z,11Z-octadecadienyl)-2-(5-hydroxy-8-oxo-6E-octenoyl)-sn-glycero-3-phosphocholine C34H62NO9P 659.4162
LMISGP20019FQM PC(P-18:1(11Z)/8:1(6E)(5OH,8OH,8Ke)) 1-(1Z,11Z-octadecadienyl)-2-(5-hydroxy-7-carboxy-6E-heptenoyl)-sn-glycero-3-phosphocholine C34H62NO10P 675.4111
LMISGP20019FQN PC(P-18:1(11Z)/9:0(9Ke)) 1-(1Z,11Z-octadecadienyl)-2-(9-oxo-nonanoyl)-sn-glycero-3-phosphocholine C35H66NO8P 659.4526
LMISGP20019FQO PC(P-18:1(11Z)/9:0(9OH,9Ke)) 1-(1Z,11Z-octadecadienyl)-2-azeloyl-sn-glycero-3-phosphocholine C35H66NO9P 675.4475
LMISGP20019FQP PC(P-18:1(11Z)/9:2(5E,7E)(4Ke,9Ke)) 1-(1Z,11Z-octadecadienyl)-2-(4,9-dioxo-5E,7E-nonadienoyl)-sn-glycero-3-phosphocholine C35H60NO9P 669.4006
LMISGP20019FOU PC(P-18:1(11Z)/11:1(9E)(11Ke)) 1-(1Z,11Z-octadecadienyl)-2-(11-Oxo-9E-undecenoyl)-sn-glycero-3-phosphocholine C37H68NO8P 685.4683
LMISGP20019FOV PC(P-18:1(11Z)/11:2(6E,8E)(5OH,10OH,11Ke)) 1-(1Z,11Z-octadecadienyl)-2-(5,10-Dihydroxy-11-oxo-6E,8E-undecadienoyl)-sn-glycero-3-phosphocholine C37H66NO10P 715.4424
LMISGP20019FOW PC(P-18:1(11Z)/12:0(9Ke,12Ke)) 1-(1Z,11Z-octadecadienyl)-2-(9,12-dioxodecanoyl)-sn-glycero-3-phosphocholine C38H70NO9P 715.4788
LMISGP20019FOX PC(P-18:1(11Z)/12:1(10E)(9Ke,12OH,12Ke)) 1-(1Z,11Z-octadecadienyl)-2-(9-oxo-11-carboxy-10E-undecenoyl)-sn-glycero-3-phosphocholine C38H68NO10P 729.4581
LMISGP20019FOY PC(P-18:1(11Z)/12:1(10E)(9OH,12Ke)) 1-(1Z,11Z-octadecadienyl)-2-(9-hydroxy-12-oxo-10E-dodecenoyl)-sn-glycero-3-phosphocholine C38H70NO9P 715.4788
LMISGP20019FOZ PC(P-18:1(11Z)/12:1(10E)(9OH,12OH,12Ke)) 1-(1Z,11Z-octadecadienyl)-2-(9-hydroxy-11-carboxy-10E-undecenoyl)-sn-glycero-3-phosphocholine C38H70NO10P 731.4737
LMISGP20019FO0 PC(P-18:1(11Z)/13:2(9E,11E)(13Ke)) 1-(1Z,11Z-octadecadienyl)-2-(13-oxo-9E,11E-tridecedienoyl)-sn-glycero-3-phosphocholine C39H70NO8P 711.4839
LMISGP20019FO1 PC(P-18:1(11Z)/13:2(9E,11E)(8Ke,13Ke)) 1-(1Z,11Z-octadecadienyl)-2-(8,13-dioxo-9E,11E-tridecadienoyl)-sn-glycero-3-phosphocholine C39H68NO9P 725.4632
LMISGP20019FO2 PC(P-18:1(11Z)/13:2(9E,11E)(8OH,13Ke)) 1-(1Z,11Z-octadecadienyl)-2-(8-hydroxy-13-oxo-9E,11E-tridecadienoyl)-sn-glycero-3-phosphocholine C39H70NO9P 727.4788
LMISGP20019FO3 PC(P-18:1(11Z)/13:3(5Z,8E,11E)(10OH,13Ke)) 1-(1Z,11Z-octadecadienyl)-2-(10-hydroxy-13-oxo-5Z,8E,11E-tridecatrienoyl)-sn-glycero-3-phosphocholine C39H68NO9P 725.4632
LMISGP20019FO4 PC(P-18:1(11Z)/18:2(10E,12Z)(9OH[R])) 1-(1Z,11Z-octadecadienyl)-2-(9R-HODE)-sn-glycero-3-phosphocholine C44H82NO8P 783.5778
LMISGP20019FO5 PC(P-18:1(11Z)/18:2(10E,12Z)(9OH[S])) 1-(1Z,11Z-octadecadienyl)-2-(9S-HODE)-sn-glycero-3-phosphocholine C44H82NO8P 783.5778
LMISGP20019FO6 PC(P-18:1(11Z)/18:2(8E,12Z)(10OH[R])) 1-(1Z,11Z-octadecadienyl)-2-(10R-HODE)-sn-glycero-3-phosphocholine C44H82NO8P 783.5778
LMISGP20019FO7 PC(P-18:1(11Z)/18:2(8E,12Z)(10OH[S])) 1-(1Z,11Z-octadecadienyl)-2-(10S-HODE)-sn-glycero-3-phosphocholine C44H82NO8P 783.5778
LMISGP20019FO8 PC(P-18:1(11Z)/18:2(9Z,11E)(13OH[R])) 1-(1Z,11Z-octadecadienyl)-2-(13R-HODE)-sn-glycero-3-phosphocholine C44H82NO8P 783.5778
LMISGP20019FO9 PC(P-18:1(11Z)/18:2(9Z,11E)(13OH[S])) 1-(1Z,11Z-octadecadienyl)-2-(13S-HODE)-sn-glycero-3-phosphocholine C44H82NO8P 783.5778
LMISGP20019FPA PC(P-18:1(11Z)/18:2(9Z,12Z)(8OH[R])) 1-(1Z,11Z-octadecadienyl)-2-(8R-HODE)-sn-glycero-3-phosphocholine C44H82NO8P 783.5778
LMISGP20019FPB PC(P-18:1(11Z)/18:2(9Z,12Z)(8OH[S])) 1-(1Z,11Z-octadecadienyl)-2-(8S-HODE)-sn-glycero-3-phosphocholine C44H82NO8P 783.5778
LMISGP20019FPC PC(P-18:1(11Z)/18:2(9Z,15Z)(12OH[R])) 1-(1Z,11Z-octadecadienyl)-2-(12R-HODE)-sn-glycero-3-phosphocholine C44H82NO8P 783.5778
LMISGP20019FPD PC(P-18:1(11Z)/18:2(9Z,15Z)(12OH[S])) 1-(1Z,11Z-octadecadienyl)-2-(12S-HODE)-sn-glycero-3-phosphocholine C44H82NO8P 783.5778
LMISGP20019FPF PC(P-18:1(11Z)/20:2(5Z,13E)(11OH[R],9Ke,15OH[S]){8a,12b}) 1-(1Z,11Z-octadecadienyl)-2-PGE2-sn-glycero-3-phosphocholine C46H82NO10P 839.5676
LMISGP20019FPG PC(P-18:1(11Z)/20:2(5Z,13E)(9OH[S],11Ke,15OH[S]){8a,12b}) 1-(1Z,11Z-octadecadienyl)-2-PGD2-sn-glycero-3-phosphocholine C46H82NO10P 839.5676
LMISGP20019FPH PC(P-18:1(11Z)/20:2(7E,14Z)(5Ep,9Ke,11OH){8,12}) 1-(1Z,11Z-octadecadienyl)-2-(5,6-epoxy-isoPE2)-sn-glycero-3-phosphocholine C46H80NO10P 837.5520
LMISGP20019FPI PC(P-18:1(11Z)/20:3(7E,10Z,14Z)(5Ep,9Ke){8,12}) 1-(1Z,11Z-octadecadienyl)-2-(5,6-epoxycyclopentenone)-sn-glycero-3-phosphocholine C46H78NO9P 819.5414
LMISGP20019FPJ PC(P-18:1(11Z)/20:4(5Z,7E,11Z,14Z)(9Ke)) 1-(1Z,11Z-octadecadienyl)-2-(9-Oxo-ETE)-sn-glycero-3-phosphocholine C46H80NO8P 805.5622
LMISGP20019FPK PC(P-18:1(11Z)/20:4(5Z,7E,11Z,14Z)(9OH[S])) 1-(1Z,11Z-octadecadienyl)-2-(9S-HETE)-sn-glycero-3-phosphocholine C46H82NO8P 807.5778
LMISGP20019FPL PC(P-18:1(11Z)/20:4(5Z,8Z,10E,14Z)(12Ke)) 1-(1Z,11Z-octadecadienyl)-2-(12-Oxo-ETE)-sn-glycero-3-phosphocholine C46H80NO8P 805.5622
LMISGP20019FPM PC(P-18:1(11Z)/20:4(5Z,8Z,10E,14Z)(12OH[S])) 1-(1Z,11Z-octadecadienyl)-2-(12S-HETE)-sn-glycero-3-phosphocholine C46H82NO8P 807.5778
LMISGP20019FPN PC(P-18:1(11Z)/20:4(5Z,8Z,11Z,13E)(15Ke)) 1-(1Z,11Z-octadecadienyl)-2-(15-Oxo-ETE)-sn-glycero-3-phosphocholine C46H80NO8P 805.5622
LMISGP20019FPO PC(P-18:1(11Z)/20:4(5Z,8Z,11Z,13E)(15OH[S])) 1-(1Z,11Z-octadecadienyl)-2-(15S-HETE)-sn-glycero-3-phosphocholine C46H82NO8P 807.5778
LMISGP20019FPP PC(P-18:1(11Z)/20:4(5Z,8Z,12E,14Z)(11Ke)) 1-(1Z,11Z-octadecadienyl)-2-(11-oxo-ETE)-sn-glycero-3-phosphocholine C46H80NO8P 805.5622
LMISGP20019FPQ PC(P-18:1(11Z)/20:4(5Z,8Z,12E,14Z)(11OH[S])) 1-(1Z,11Z-octadecadienyl)-2-(11S-HETE)-sn-glycero-3-phosphocholine C46H82NO8P 807.5778