Structure Database (LMSD)

LM_ID Common Name Systematic Name Main class Sub class Mass Formula
LMFA07050401 9E-Dodecenoyl-CoA 9E-Dodecenoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 947.27 C33H56N7O17P3S
LMFA07050030 Acetoacetyl-CoA Acetoacetyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 851.14 C25H40N7O18P3S
LMFA07050281 Acetyl-CoA Acetyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 809.13 C23H38N7O17P3S
LMFA07050284 Adipoyl-CoA 6-[(2-{3-[(2R)-3-[({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)methyl]-2-hydroxy-3-methylbutanamido]propanamido}ethyl)sulfanyl]-6-oxohexanoic acid Fatty esters [FA07] Fatty acyl CoAs [FA0705] 895.16 C27H44N7O19P3S
LMFA07050288 Arachidonyl-CoA 5Z,8Z,11Z,14Z-eicosatetraenoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1053.34 C41H66N7O17P3S
LMFA07050329 Arachidoyl-CoA Eicosanoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1061.41 C41H74N7O17P3S
LMFA07050289 Behenoyl-CoA Docosanoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1089.44 C43H78N7O17P3S
LMFA07050292 Butyryl-CoA 3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(butanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate) Fatty esters [FA07] Fatty acyl CoAs [FA0705] 837.16 C25H42N7O17P3S
LMFA07050327 Cerotoyl-CoA Hexacosanoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1145.5 C47H86N7O17P3S
LMFA07050294 Cinnamoyl-CoA 3-Phenyl-2E-propenoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 897.16 C30H42N7O17P3S
LMFA07050060 CoA(18:2(6Z,9Z)) 6Z,9Z-octadecadienoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1029.34 C39H66N7O17P3S
LMFA07050036 CoA(20:2(11Z,14Z)) 11Z,14Z-eicosadienoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1057.38 C41H70N7O17P3S
LMFA07050061 CoA(20:2(8Z,11Z)) 8Z,11Z-eicosadienoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1057.38 C41H70N7O17P3S
LMFA07050044 CoA(20:3(11Z,14Z,17Z)) 11Z,14Z,17Z-eicosatrienoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1055.36 C41H68N7O17P3S
LMFA07050062 CoA(20:3(5Z,8Z,11Z)) 5Z,8Z,11Z-eicosatrienoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1055.36 C41H68N7O17P3S
LMFA07050037 CoA(22:2(13Z,16Z)) 13Z,16Z-docosadienoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1085.41 C43H74N7O17P3S
LMFA07050043 CoA(22:5(4Z,7Z,10Z,13Z,16Z)) 4Z,7Z,10Z,13Z,16Z-docosapentaenoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1079.36 C43H68N7O17P3S
LMFA07050042 CoA(24:5(6Z,9Z,12Z,15Z,18Z)) 6Z,9Z,12Z,15Z,18Z-tetracosapentaenoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1107.39 C45H72N7O17P3S
LMFA07050307 Crotonoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E)-but-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 835.14 C25H40N7O17P3S
LMFA07050315 Dephospho-CoA [({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy][3-hydroxy-2,2-dimethyl-3-({2-[(2-sulfanylethyl)carbamoyl]ethyl}carbamoyl)propoxy]phosphinic acid Fatty esters [FA07] Fatty acyl CoAs [FA0705] 687.15 C21H35N7O13P2S
LMFA07050492 Elaidoyl-CoA 9E-octadecanoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1031.36 C39H68N7O17P3S
LMFA07050326 Enanthyl-CoA Heptanoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 879.2 C28H48N7O17P3S
LMFA07050324 Glutaryl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(4-carboxybutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 881.15 C26H42N7O19P3S
LMFA07050325 Heptadecanoyl CoA {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-2-({[({[(3R)-3-[(2-{[2-(heptadecanoylsulfanyl)ethyl]carbamoyl}ethyl)carbamoyl]-3-hydroxy-2,2-dimethylpropoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]oxy}methyl)-4-hydroxyoxolan-3-yl]oxy}phosphonic acid Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1019.36 C38H68N7O17P3S
LMFA07050328 Hexanoyl-CoA Hexanoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 865.19 C27H46N7O17P3S
LMFA07050331 Isobutyryl-CoA {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-2,2-dimethyl-3-{[2-({2-[(2-methylpropanoyl)sulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}propoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid Fatty esters [FA07] Fatty acyl CoAs [FA0705] 837.16 C25H42N7O17P3S
LMFA07050336 Isovaleryl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(3-methylbutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 851.17 C26H44N7O17P3S
LMFA07050491 Juniperonyl-CoA 5Z,11Z,14Z,17Z-eicosatetraenoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1053.34 C41H66N7O17P3S
LMFA07050338 L-3-aminobutanoyl-CoA 3S-aminobutanoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 852.17 C25H43N8O17P3S
LMFA07050342 L-erythro-3-methylmalyl-CoA 2S-methyl-3R-hydroxy-4-carboxybutanoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 897.14 C26H42N7O20P3S
LMFA07050339 Lactyl-CoA {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-3-{[2-({2-[(2-hydroxypropanoyl)sulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}-2,2-dimethylpropoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid Fatty esters [FA07] Fatty acyl CoAs [FA0705] 839.14 C24H40N7O18P3S
LMFA07050340 Lauroyl-CoA Dodecanoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 949.28 C33H58N7O17P3S
LMFA07050372 Lignoceroyl-CoA Tetracosanoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1117.47 C45H82N7O17P3S
LMFA07050343 Linoleoyl-CoA 9Z-12Z-octadecadienoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1029.34 C39H66N7O17P3S
LMFA07050345 Malonyl-CoA Malonyl CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 853.12 C24H38N7O19P3S
LMFA07050347 Malonyl-CoA semialdehyde 3-Oxopropanoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 837.12 C24H38N7O18P3S
LMFA07050115 Malyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(3S)-3-carboxy-3-hydroxypropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 883.13 C25H40N7O20P3S
LMFA07050350 Methacrylyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methylprop-2-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 835.14 C25H40N7O17P3S
LMFA07050353 N-methylanthraniloyl-CoA N-methylanthraniloyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 900.17 C29H43N8O17P3S
LMFA07050486 OPC8-CoA (9S,13S)-10,11-dihydro-12-oxo-15-phytoenoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1043.32 C39H64N7O18P3S
LMFA07050355 Octanoyl-CoA {[5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({[hydroxy({3-hydroxy-2,2-dimethyl-3-[(2-{[2-(octanoylsulfanyl)ethyl]carbamoyl}ethyl)carbamoyl]propoxy})phosphoryl]oxy})phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid Fatty esters [FA07] Fatty acyl CoAs [FA0705] 893.22 C29H50N7O17P3S
LMFA07050358 Palmitelaidoyl-CoA 9E-hexadecenoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1003.33 C37H64N7O17P3S
LMFA07050360 Palmitoyl-CoA Hexadecanoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1005.34 C37H66N7O17P3S
LMFA07050364 Propionyl-CoA 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-(propanoylsulfanyl)ethyl]amino}propyl)amino]butyl} dihydrogen diphosphate) Fatty esters [FA07] Fatty acyl CoAs [FA0705] 823.14 C24H40N7O17P3S
LMFA07050365 Pseudoecgonyl-CoA {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[3-hydroxy-3-({2-[(2-{[(2S,3S)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-2-yl]carbonylsulfanyl}ethyl)carbamoyl]ethyl}carbamoyl)-2,2-dimethylpropoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid Fatty esters [FA07] Fatty acyl CoAs [FA0705] 934.21 C30H49N8O18P3S
LMFA07050366 S-(5-Hydroxy-2-furoyl)-CoA [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] [(3R)-3-hydroxy-4-[[3-[2-[(Z)-hydroxy-(5-oxo-2-furylidene)methyl]sulfanylethylamino]-3-oxo-propyl]amino]-2,2-dimethyl-4-oxo-butyl] hydrogen phosphate Fatty esters [FA07] Fatty acyl CoAs [FA0705] 877.12 C26H38N7O19P3S
LMFA07050367 Salicyl CoA {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({[hydroxy(3-hydroxy-2,2-dimethyl-3-{[2-({2-[(2-hydroxyphenyl)carbonylsulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}propoxy)phosphoryl]oxy})phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid Fatty esters [FA07] Fatty acyl CoAs [FA0705] 887.14 C28H40N7O18P3S
LMFA07050490 Sebaleoyl CoA 5Z,8Z-octadecadienoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1029.34 C39H66N7O17P3S
LMFA07050123 Stearidonoyl-CoA 6Z,9Z,12Z,15Z-octadecatetraenoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1025.31 C39H62N7O17P3S
LMFA07050369 Stearoyl-CoA Octadecanoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1033.38 C39H70N7O17P3S