Structure Database (LMSD)

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LMSD: Lipid classification search results

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Fatty Acids and Conjugates [FA01]

LM_ID Common Name Systematic Name Species Shorthand Formula Mass
LMFA01050457 (R)-3-hydroxy-3-methyl-2-oxopentanoic acid (3R)-3-hydroxy-3-methyl-2-oxopentanoic acid FA 6:1;O2 C6H10O4 146.057910
LMFA01050457 (R)-3-hydroxy-3-methyl-2-oxopentanoic acid (3R)-3-hydroxy-3-methyl-2-oxopentanoic acid FA 6:1;O2 C6H10O4 146.057910
LMFA01050457 (R)-3-hydroxy-3-methyl-2-oxopentanoic acid (3R)-3-hydroxy-3-methyl-2-oxopentanoic acid FA 6:1;O2 C6H10O4 146.057910
LMFA01030927 (2E,4Z)-4-hydroxy-6-oxohexa-2,4-dienoic acid (2E,4Z)-4-hydroxy-6-oxohexa-2,4-dienoic acid FA 6:3;O2 C6H6O4 142.026610
LMFA01030927 (2E,4Z)-4-hydroxy-6-oxohexa-2,4-dienoic acid (2E,4Z)-4-hydroxy-6-oxohexa-2,4-dienoic acid FA 6:3;O2 C6H6O4 142.026610
LMFA01031015 mediomycin A (2E,4E,6E,10E,13S,14S,15R,16E,18E,20E,22E,24E,26E,33R,35S,36E,39S,41R,43S,44E,47R,49S,50E,53R,55S)-58-amino-13,15,33,35,39,41,43,47,49,53,55-undecahydroxy-2,12,14,30-tetramethyl-31-oxo-29-(sulfooxy)octapentaconta-2,4,6,10,16,18,20,22,24,26,36,44,50-tridecaenoic acid C62H97NO18S 1175.642641
LMFA01031015 mediomycin A (2E,4E,6E,10E,13S,14S,15R,16E,18E,20E,22E,24E,26E,33R,35S,36E,39S,41R,43S,44E,47R,49S,50E,53R,55S)-58-amino-13,15,33,35,39,41,43,47,49,53,55-undecahydroxy-2,12,14,30-tetramethyl-31-oxo-29-(sulfooxy)octapentaconta-2,4,6,10,16,18,20,22,24,26,36,44,50-tridecaenoic acid C62H97NO18S 1175.642641
LMFA01031015 mediomycin A (2E,4E,6E,10E,13S,14S,15R,16E,18E,20E,22E,24E,26E,33R,35S,36E,39S,41R,43S,44E,47R,49S,50E,53R,55S)-58-amino-13,15,33,35,39,41,43,47,49,53,55-undecahydroxy-2,12,14,30-tetramethyl-31-oxo-29-(sulfooxy)octapentaconta-2,4,6,10,16,18,20,22,24,26,36,44,50-tridecaenoic acid C62H97NO18S 1175.642641
LMFA01031015 mediomycin A (2E,4E,6E,10E,13S,14S,15R,16E,18E,20E,22E,24E,26E,33R,35S,36E,39S,41R,43S,44E,47R,49S,50E,53R,55S)-58-amino-13,15,33,35,39,41,43,47,49,53,55-undecahydroxy-2,12,14,30-tetramethyl-31-oxo-29-(sulfooxy)octapentaconta-2,4,6,10,16,18,20,22,24,26,36,44,50-tridecaenoic acid C62H97NO18S 1175.642641
LMFA01031015 mediomycin A (2E,4E,6E,10E,13S,14S,15R,16E,18E,20E,22E,24E,26E,33R,35S,36E,39S,41R,43S,44E,47R,49S,50E,53R,55S)-58-amino-13,15,33,35,39,41,43,47,49,53,55-undecahydroxy-2,12,14,30-tetramethyl-31-oxo-29-(sulfooxy)octapentaconta-2,4,6,10,16,18,20,22,24,26,36,44,50-tridecaenoic acid C62H97NO18S 1175.642641
LMFA08020183 IC202B N-(5-aminopentyl)-N-hydroxy-N'-[5-(hydroxy{4-[(5-nitropentyl)amino]-4-oxobutanoyl}amino)pentyl]butanediamide C23H44N6O8 532.322064
LMFA07070053 Butenylcarnitine (3S)-3-[(2E)-but-2-enoyloxy]-4-(trimethylazaniumyl)butanoate CAR 4:1 C11H19NO4 229.131409
LMFA07050205 3-Hydroxy-2,6-dimethyl-5-methylene-heptanoyl-CoA {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-3-{[2-({2-[(3-hydroxy-2,6-dimethyl-5-methylideneheptanoyl)sulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}-2,2-dimethylpropoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid CoA 10:1;O C31H52N7O18P3S 935.230249
LMFA07050205 3-Hydroxy-2,6-dimethyl-5-methylene-heptanoyl-CoA {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-3-{[2-({2-[(3-hydroxy-2,6-dimethyl-5-methylideneheptanoyl)sulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}-2,2-dimethylpropoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid CoA 10:1;O C31H52N7O18P3S 935.230249
LMFA07050205 3-Hydroxy-2,6-dimethyl-5-methylene-heptanoyl-CoA {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-3-{[2-({2-[(3-hydroxy-2,6-dimethyl-5-methylideneheptanoyl)sulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}-2,2-dimethylpropoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid CoA 10:1;O C31H52N7O18P3S 935.230249
LMFA07050205 3-Hydroxy-2,6-dimethyl-5-methylene-heptanoyl-CoA {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-3-{[2-({2-[(3-hydroxy-2,6-dimethyl-5-methylideneheptanoyl)sulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}-2,2-dimethylpropoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid CoA 10:1;O C31H52N7O18P3S 935.230249
LMFA07050205 3-Hydroxy-2,6-dimethyl-5-methylene-heptanoyl-CoA {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-3-{[2-({2-[(3-hydroxy-2,6-dimethyl-5-methylideneheptanoyl)sulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}-2,2-dimethylpropoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid CoA 10:1;O C31H52N7O18P3S 935.230249
LMFA07050224 3-hydroxypimeloyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(6-carboxy-3-hydroxyhexanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} CoA 7:1;O3 C28H46N7O20P3S 925.173129
LMFA07050224 3-hydroxypimeloyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(6-carboxy-3-hydroxyhexanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} CoA 7:1;O3 C28H46N7O20P3S 925.173129
LMFA07050224 3-hydroxypimeloyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(6-carboxy-3-hydroxyhexanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} CoA 7:1;O3 C28H46N7O20P3S 925.173129
LMFA07050224 3-hydroxypimeloyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(6-carboxy-3-hydroxyhexanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} CoA 7:1;O3 C28H46N7O20P3S 925.173129
LMFA07050224 3-hydroxypimeloyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(6-carboxy-3-hydroxyhexanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} CoA 7:1;O3 C28H46N7O20P3S 925.173129
LMFA07050379 trans-2,3-didehydroadipoyl-CoA 6-carboxy-2E-hexenoyl-CoA CoA 6:2;O2 C27H42N7O19P3S 893.146914
LMFA07050379 trans-2,3-didehydroadipoyl-CoA 6-carboxy-2E-hexenoyl-CoA CoA 6:2;O2 C27H42N7O19P3S 893.146914
LMFA07050379 trans-2,3-didehydroadipoyl-CoA 6-carboxy-2E-hexenoyl-CoA CoA 6:2;O2 C27H42N7O19P3S 893.146914
LMFA07050379 trans-2,3-didehydroadipoyl-CoA 6-carboxy-2E-hexenoyl-CoA CoA 6:2;O2 C27H42N7O19P3S 893.146914
LMFA07050379 trans-2,3-didehydroadipoyl-CoA 6-carboxy-2E-hexenoyl-CoA CoA 6:2;O2 C27H42N7O19P3S 893.146914
LMFA07010711 1-Methyl-2-oxopropyl butyrate 3-oxobutan-2-yl butanoate SFE 8:1;O C8H14O3 158.094295
LMFA07010933 Methyl (R)-3-methyl-2-oxopentanoate methyl 3-methyl-2-oxopentanoate SFE 7:1;O C7H12O3 144.078645
LMFA07010933 Methyl (R)-3-methyl-2-oxopentanoate methyl 3-methyl-2-oxopentanoate SFE 7:1;O C7H12O3 144.078645
LMFA07010950 Methyl 3-methylbutanoate methyl 3-methylbutanoate SFE 6:0 C6H12O2 116.083730
LMFA01031142 (Z)-16-oxo-octadeca-9,17-dien-12,14-diynoic acid 16-oxo-octadeca-9Z,17-dien-12,14-diynoic acid FA 18:7;O C18H22O3 286.156895
LMFA01031142 (Z)-16-oxo-octadeca-9,17-dien-12,14-diynoic acid 16-oxo-octadeca-9Z,17-dien-12,14-diynoic acid FA 18:7;O C18H22O3 286.156895
LMFA01020063 4-methyl lauric acid 4-methyl-dodecanoic acid FA 13:0 C13H26O2 214.193280
LMFA01020150 2,2-dimethyl-hexanoic acid 2,2-dimethyl-hexanoic acid FA 8:0 C8H16O2 144.115030
LMFA01140064 9-phenyl nonanoic acid 9-phenyl-nonanoic acid FA 15:4 C15H22O2 234.161980
LMFA01140064 9-phenyl nonanoic acid 9-phenyl-nonanoic acid FA 15:4 C15H22O2 234.161980
LMFA07030007 Type IV cyanolipid 18:2 ester (1-cyano-2-methylprop-2-en-1-yl) 9Z,12Z-octadecadienoate C23H37NO2 359.282429
LMFA07030007 Type IV cyanolipid 18:2 ester (1-cyano-2-methylprop-2-en-1-yl) 9Z,12Z-octadecadienoate C23H37NO2 359.282429
LMFA04030006 AT-Resolvin D2 7S,16R,17R-trihydroxy-4Z,8E,10Z,12E,14E,19Z-docosahexaenoic acid FA 22:6;O3 C22H32O5 376.224975
LMFA04030006 AT-Resolvin D2 7S,16R,17R-trihydroxy-4Z,8E,10Z,12E,14E,19Z-docosahexaenoic acid FA 22:6;O3 C22H32O5 376.224975
LMFA03140001 10,11-dihydro-Resolvin E1 5S,12,18S-trihydroxy-6Z,8E,14Z,16E-eicosatetraenoic acid FA 20:4;O3 C20H32O5 352.224975
LMFA03140001 10,11-dihydro-Resolvin E1 5S,12,18S-trihydroxy-6Z,8E,14Z,16E-eicosatetraenoic acid FA 20:4;O3 C20H32O5 352.224975
LMFA04000087 5Z,13Z,16Z,19Z-Docosatetraenoic acid 5Z,13Z,16Z,19Z-Docosatetraenoic acid FA 22:4 C22H36O2 332.271530
LMFA01070027 8,9-Epoxy-2Z-decene-4,6-diynoic acid 8,9-Epoxy-2Z-decene-4,6-diynoic acid FA 10:6;O C10H8O3 176.047345
LMFA01070027 8,9-Epoxy-2Z-decene-4,6-diynoic acid 8,9-Epoxy-2Z-decene-4,6-diynoic acid FA 10:6;O C10H8O3 176.047345
LMFA01031030 Alvaradonic acid octa­dec-17-en-8-ynoic acid FA 18:3 C18H30O2 278.224580
LMFA01031148 (E)-octadec-13-en-11-ynoic acid Octadeca-13E-en-11-ynoic acid FA 18:3 C18H30O2 278.224580
LMFA01150052 4-methyl-5-carboxyethyl-2-furanacrylic acid 3-(5-(2-carboxyethyl)-4-methylfuran-2-yl)-2E-propenoic acid FA 11:5;O3 C11H12O5 224.068475
LMFA01150052 4-methyl-5-carboxyethyl-2-furanacrylic acid 3-(5-(2-carboxyethyl)-4-methylfuran-2-yl)-2E-propenoic acid FA 11:5;O3 C11H12O5 224.068475