Structure Database (LMSD)

LM_ID Common Name Systematic Name Main class Sub class Mass Formula
LMFA02000043 gamma- 9(10)-EpODE 9(10)-epoxy-6Z,12Z-octadecadienoic acid Octadecanoids [FA02] Other Octadecanoids [FA0200] 294.22 C18H30O3
LMFA02000049 gamma- 9,10-DiHODE (+/-)-9,10-dihydroxy-6Z,12Z-octadecadienoic acid Octadecanoids [FA02] Other Octadecanoids [FA0200] 312.23 C18H32O4
LMFA02000486 7S,8S-dihydroxy-13-oxo-octadeca-9E,11E-dienoic acid Octadecanoids [FA02] Other Octadecanoids [FA0200] 326.21 C18H30O5
LMFA02000408 8-(2-butyl-6R-hydroxy-3-oxocyclohex-1-en-yl)octanoic acid Octadecanoids [FA02] Other Octadecanoids [FA0200] 310.21 C18H30O4
LMFA02000393 9-hydroxy-10-oxo-12(Z),15(Z)-octadecadienoic acid Octadecanoids [FA02] Other Octadecanoids [FA0200] 310.21 C18H30O4
LMFA02000460 14-oxo-12E-octadecenoic acid Octadecanoids [FA02] Other Octadecanoids [FA0200] 296.24 C18H32O3
LMFA02000370 4-oxo-2E-octadecenoic acid Octadecanoids [FA02] Other Octadecanoids [FA0200] 296.24 C18H32O3
LMFA02000361 6,9R,10S-trihydroxy-7E12Z,15Z-octadecatrienoic acid Octadecanoids [FA02] Other Octadecanoids [FA0200] 326.21 C18H30O5
LMFA02000368 4-oxo-2E,17-octadecadienoic acid Octadecanoids [FA02] Other Octadecanoids [FA0200] 294.22 C18H30O3
LMFA02000366 4-oxo-2E,11Z,17-octadecatrienoic acid Octadecanoids [FA02] Other Octadecanoids [FA0200] 292.2 C18H28O3
LMFA02000410 7-(5S-hydroxy-2-oxo-2-pentylcyclohex-1-en-yl)heptanoic acid Octadecanoids [FA02] Other Octadecanoids [FA0200] 310.21 C18H30O4
LMFA02000360 9S,10R,11R-trihydroxy-12Z,15Z-octadecadienoic acid Octadecanoids [FA02] Other Octadecanoids [FA0200] 328.22 C18H32O5
LMFA02000380 12-methyl-17-octadecene-5-ynoic acid Octadecanoids [FA02] Other Octadecanoids [FA0200] 292.24 C19H32O2
LMFA02000409 8-(2-butyl-6S-hydroxy-3-oxocyclohex-1-en-yl)octanoic acid Octadecanoids [FA02] Other Octadecanoids [FA0200] 310.21 C18H30O4
LMFA02000363 8R,9R,10S-trihydroxy-6Z-octadecenoic acid Octadecanoids [FA02] Other Octadecanoids [FA0200] 330.24 C18H34O5
LMFA02000485 12S,13S-dihydroxy-7-oxo-octadeca-8E,10E-dienoic acid Octadecanoids [FA02] Other Octadecanoids [FA0200] 326.21 C18H30O5
LMFA02000367 4-oxo-2E,11Z-octadecadienoic acid Octadecanoids [FA02] Other Octadecanoids [FA0200] 294.22 C18H30O3
LMFA02000411 7-(5R-hydroxy-2-oxo-2-pentylcyclohex-1-en-yl)heptanoic acid Octadecanoids [FA02] Other Octadecanoids [FA0200] 310.21 C18H30O4
LMFA02000369 4-oxo-2E,9E-octadecadienoic acid Octadecanoids [FA02] Other Octadecanoids [FA0200] 294.22 C18H30O3
LMFA02000364 10,11-dihydroxyoctadeca-9E,12Z-dienoic acid Octadecanoids [FA02] Other Octadecanoids [FA0200] 312.23 C18H32O4
LMFA02000362 6,9R,10R-trihydroxy-7E12Z,15Z-octadecatrienoic acid Octadecanoids [FA02] Other Octadecanoids [FA0200] 326.21 C18H30O5
LMFA02000365 4-oxo-2E,9E,17-octadecatrienoic acid Octadecanoids [FA02] Other Octadecanoids [FA0200] 292.2 C18H28O3
LMFA02010017 (1R,2R)-3-oxo-2-pentyl-cyclopentanebutanoic acid (1R,2R)-3-oxo-2-pentyl-cyclopentanebutanoic acid Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 240.17 C14H24O3
LMFA02010014 (1R,2R)-3-oxo-2-pentyl-cyclopentanehexanoic acid (1R,2R)-3-oxo-2-pentyl-cyclopentanehexanoic acid Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 268.2 C16H28O3
LMFA02010012 (1R,2R)-3-oxo-2-pentyl-cyclopentaneoctanoic acid (1R,2R)-3-oxo-2-pentyl-cyclopentaneoctanoic acid Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 296.24 C18H32O3
LMFA02010016 (1S,2S)-3-oxo-2-pentyl-cyclopentanebutanoic acid (1S,2S)-3-oxo-2-pentyl-cyclopentanebutanoic acid Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 240.17 C14H24O3
LMFA02010015 (1S,2S)-3-oxo-2-pentyl-cyclopentanehexanoic acid (1S,2S)-3-oxo-2-pentyl-cyclopentanehexanoic acid Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 268.2 C16H28O3
LMFA02010013 (1S,2S)-3-oxo-2-pentyl-cyclopentaneoctanoic acid (1S,2S)-3-oxo-2-pentyl-cyclopentaneoctanoic acid Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 296.24 C18H32O3
LMFA02010006 (9R,13R)-10,11-dihydro-12-oxo-15-phytoenoic acid (1R,2R)-3-oxo-2-(2'Z-pentenyl)-cyclopentaneoctanoic acid Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 294.22 C18H30O3
LMFA02010002 (9R,13R)-10-oxo-11-phytoenoic acid (9R,13R)-2-oxo-5-pentyl-3-cyclopentene-1-octanoic acid Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 294.22 C18H30O3
LMFA02010004 (9R,13R)-15,16-dihydro-12-oxo-10-phytoenoic acid (1R,2R)-4-oxo-5-pentyl-2-cyclopentene-1-octanoic acid Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 294.22 C18H30O3
LMFA02010010 (9R,13R)-1a,1b-dihomo-jasmonic acid (1R,2R)-3-oxo-2-(2'Z-pentenyl)-cyclopentanebutanoic acid Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 238.16 C14H22O3
LMFA02010008 (9R,13R)-1a,1b-dinor-10,11-dihydro-12-oxo-15-phytoenoic acid (1R,2R)-3-oxo-2-(2'Z-pentenyl)cyclopentanehexanoic acid Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 266.19 C16H26O3
LMFA02010007 (9S,13S)-10,11-dihydro-12-oxo-15-phytoenoic acid (1S,2S)-3-oxo-2-(2'Z-pentenyl)-cyclopentaneoctanoic acid Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 294.22 C18H30O3
LMFA02010003 (9S,13S)-10-oxo-11-phytoenoic acid (9S,13S)-2-oxo-5-pentyl-3-cyclopentene-1-octanoic acid Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 294.22 C18H30O3
LMFA02010005 (9S,13S)-15,16-dihydro-12-oxo-10-phytoenoic acid (1S,2S)-4-oxo-5-pentyl-2-cyclopentene-1-octanoic acid Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 294.22 C18H30O3
LMFA02010011 (9S,13S)-1a,1b-dihomo-jasmonic acid (1S,2S)-3-oxo-2-(2'Z-pentenyl)-cyclopentanebutanoic acid Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 238.16 C14H22O3
LMFA02010009 (9S,13S)-1a,1b-dinor-10,11-dihydro-12-oxo-15-phytoenoic acid (1S,2S)-3-oxo-2-(2'Z-pentenyl)cyclopentanehexanoic acid Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 266.19 C16H26O3
LMFA02010001 12-oxo-PDA (1S,2S)-3-oxo-2-(2'Z-pentenyl)cyclopent-4-eneoctanoic acid Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 292.2 C18H28O3
LMFA02010028 12-oxo-PDA-Ala N-(1S,2S)-3-oxo-2-(2'Z-pentenyl)cyclopent-4-eneoctanyl alanine Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 363.24 C21H33NO4
LMFA02010030 12-oxo-PDA-Asp N-(1S,2S)-3-oxo-2-(2'Z-pentenyl)cyclopent-4-eneoctanyl aspartic acid Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 407.23 C22H33NO6
LMFA02010029 12-oxo-PDA-Glu N-(1S,2S)-3-oxo-2-(2'Z-pentenyl)cyclopent-4-eneoctanyl glutamic acid Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 421.25 C23H35NO6
LMFA02010019 12-oxo-PDA-Ile N-(1S,2S)-3-oxo-2-(2'Z-pentenyl)cyclopent-4-eneoctanyl isoleucine Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 405.29 C24H39NO4
LMFA02010027 12-oxo-PDA-Phe N-(1S,2S)-3-oxo-2-(2'Z-pentenyl)cyclopent-4-eneoctanyl phenylalanine Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 439.27 C27H37NO4
LMFA02010026 12-oxo-PDA-Val N-(1S,2S)-3-oxo-2-(2'Z-pentenyl)cyclopent-4-eneoctanyl valine Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 391.27 C23H37NO4
LMFA02010025 14,15-dehydro-12-oxo-phytodienoic acid 8-[(5E)-4-oxo-5-[(Z)-pent-2-enylidene]cyclopent-2-en-1-yl]octanoic acid Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 290.19 C18H26O3
LMFA02010024 Chromomoric acid 8-[5-hydroxy-4-oxo-5-[(Z)-pent-2-enyl]cyclopent-2-en-1-yl]octanoic acid Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 308.2 C18H28O4
LMFA02010031 Chromomoric acid B 8-[(1S,5R)-4-oxo-5-[(Z)-pent-2-enyl]cyclopent-2-en-1-yl]octanoic acid Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 292.2 C18H28O3
LMFA02010021 Dinor-iso-12-oxo-phytodienoic acid 6-[3-oxo-2-[(Z)-pent-2-enyl]cyclopenten-1-yl]hexanoic acid Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 264.17 C16H24O3
LMFA02010022 delta4-dinor-cis-OPDA 6-(4-oxo-5-((Z)-pent-2-en-1-yl)cyclopent-2-en-1-yl)hexa-4Z-enoic acid Octadecanoids [FA02] 12-oxophytodienoic acid metabolites [FA0201] 262.16 C16H22O3