Structure Database (LMSD)

LM_ID Common Name Systematic Name Main class Sub class Mass Formula
LMFA07050138 (9Z,12Z,15Z,18Z)-3-oxotetracosatetraenoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(9Z,12Z,15Z,18Z)-3-oxotetracosa-7,10,13,16,19-tetraenoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1123.39 C45H72N7O18P3S
LMFA07050139 (9Z,12Z,15Z,18Z)-tetracosatetraenoyl-CoA 9Z,12Z,15Z,18Z-Tetracosatetraenoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1109.41 C45H74N7O17P3S
LMFA07050140 (9Z,12Z,15Z,18Z,21Z)-3-oxotetracosapentaenoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(9Z,12Z,15Z,18Z,21Z)-3-oxotetracosa-7,10,13,16,19,21-pentaenoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1121.37 C45H70N7O18P3S
LMFA07050141 (9Z,12Z,15Z,18Z,21Z)-tetracosapentaenoyl-CoA 9Z,12Z,15Z,18Z,21Z-tetracosapentaenoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1107.39 C45H72N7O17P3S
LMFA07050142 (E)-2,3-didehydropristanoyl-CoA 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-((2E)-2,6,10,14-tetramethylpentadec-2-enoylsulfanyl)ethyl]amino}propyl)amino]butyl} dihydrogen diphosphate) Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1045.38 C40H70N7O17P3S
LMFA07050143 (E)-4-(trimethylammonio)but-2-enoyl-CoA 4-trimethylammonio-2E-butenoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 893.21 C28H48N8O17P3S
LMFA07050144 (E)-hexadec-2-enoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E)-hexadec-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1003.33 C37H64N7O17P3S
LMFA07050145 (E)-isoheptadec-2-enoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(2E)-15-methylhexadec-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1017.34 C38H66N7O17P3S
LMFA07050146 (E)-isopentadec-2-enoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(2E)-13-methyltetradec-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 989.31 C36H62N7O17P3S
LMFA07050147 (E,E)-piperonyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E,4E)-5-(2H-1,3-benzodioxol-5-yl)penta-2,4-dienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 967.16 C33H44N7O19P3S
LMFA07050148 (R)-3-hydroxybutanoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3R)-3-hydroxybutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 853.15 C25H42N7O18P3S
LMFA07050149 (R)-3-hydroxyoctanoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3R)-3-hydroxyoctanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 909.21 C29H50N7O18P3S
LMFA07050150 (R)-carnitinyl-CoA betaine 2R-hydroxy-4-trimethylammonio-butanoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 910.21 C28H49N8O18P3S
LMFA07050151 (R)-lactoyl-CoA 2R-hydroxypropanoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 839.14 C24H40N7O18P3S
LMFA07050152 (R)-methylmalonyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(2R)-2-methyl-3-oxopropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 867.13 C25H40N7O19P3S
LMFA07050153 (S)-3-hydroxybutanoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxybutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 853.15 C25H42N7O18P3S
LMFA07050155 (S)-3-hydroxyhexacosanoyl-CoA 3S-hydroxyhexacosanoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1161.5 C47H86N7O18P3S
LMFA07050156 (S)-3-hydroxyhexanoyl-CoA 3S-hydroxyhexanoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 881.18 C27H46N7O18P3S
LMFA07050157 (S)-3-hydroxyisobutyryl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(2S)-3-hydroxy-2-methylpropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 853.15 C25H42N7O18P3S
LMFA07050158 (S)-3-hydroxylauroyl-CoA 3S-hydroxydodecanoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 965.28 C33H58N7O18P3S
LMFA07050159 (S)-3-hydroxyoctadecanoyl-CoA 3S-hydroxyoctadecanoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1049.37 C39H70N7O18P3S
LMFA07050160 (S)-3-hydroxyoctanoyl-CoA 3S-hydroxyoctanoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 909.21 C29H50N7O18P3S
LMFA07050161 (S)-3-hydroxypalmitoyl-CoA 3S-hydroxyhexadecanoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1021.34 C37H66N7O18P3S
LMFA07050162 (S)-carnitinyl-CoA betaine 3S-hydroxy-5-trimethylammonio-pentanoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 910.21 C28H49N8O18P3S
LMFA07050164 (S)-methylmalonyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(2S)-2-methyl-3-oxopropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 867.13 C25H40N7O19P3S
LMFA07050165 (Z)-2,3-dehydroadipoyl-CoA 6-carboxy-2Z-hexenoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 893.15 C27H42N7O19P3S
LMFA07050494 15-oxo-ETE-CoA 15-oxo-5Z,8Z,11Z,13E-eicosatetraenoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1067.32 C41H64N7O18P3S
LMFA07050168 2'-(5''-phosphoribosyl)-3'-dephospho-CoA 2'-(5-phospho-D-ribofuranosyl)adenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-sulfanylethyl)amino]propyl}amino)butyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 899.16 C26H44N7O20P3S
LMFA07050169 2'-(5-triphosphoribosyl)-3'-dephospho-CoA 2'-(5-triphospho-alpha-D-ribofuranosyl)adenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-sulfanylethyl)amino]propyl}amino)butyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1059.09 C26H46N7O26P5S
LMFA07050170 2,3-didehydropimeloyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(6-carboxyhex-2-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 907.16 C28H44N7O19P3S
LMFA07050171 2,4,7,10,13,16,19-Docosaheptaenoyl-CoA {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-2-{[({[(3-{[2-({2-[(2E,4E,7Z,10Z,13Z,16Z,19Z)-docosa-2,4,7,10,13,16,19-heptaenoylsulfanyl]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] 1075.33 C43H64N7O17P3S
LMFA07050173 2,6-dihydroxycyclohexane-1-carbonyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(2,6-dihydroxycyclohexane-1-carbonyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 909.18 C28H46N7O19P3S
LMFA07050185 2-Hydroxyphytanoyl-CoA {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[3-hydroxy-3-({2-[(2-{[(3S,7R,11R)-2-hydroxy-3,7,11,15-tetramethylhexadecanoyl]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] 1077.4 C41H74N7O18P3S
LMFA07050189 2-Methylacetoacetyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methyl-3-oxobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 865.15 C26H42N7O18P3S
LMFA07050192 2-Methylhexanoyl-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-methylhexanoyl)sulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}propoxy)phosphoryl]oxy})phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid Fatty esters [FA07] Fatty acyl CoAs [FA0705] 879.2 C28H48N7O17P3S
LMFA07050174 2-amino-5-oxocyclohex-1-enecarbonyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(2-amino-5-oxocyclohex-1-enecarbonyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 904.16 C28H43N8O18P3S
LMFA07050177 2-hydroxy-3-methylhexadecanoyl-CoA 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-4-[(3-{[2-(2-hydroxy-3-methylhexadecanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate) Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1035.36 C38H68N7O18P3S
LMFA07050178 2-hydroxy-4-isopropenylcyclohexane-1-carbonyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[2-hydroxy-4-(prop-1-en-2-yl)cyclohexane-1-carbonyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 933.21 C31H50N7O18P3S
LMFA07050179 2-hydroxy-6-oxocyclohexane-1-carbonyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(2-hydroxy-6-oxocyclohexane-1-carbonyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 907.16 C28H44N7O19P3S
LMFA07050180 2-hydroxyadipoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(5-carboxy-2-hydroxypentanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 911.16 C27H44N7O20P3S
LMFA07050181 2-hydroxybehenoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(2-hydroxydocosanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1105.43 C43H78N7O18P3S
LMFA07050182 2-hydroxycyclohexane-1-carbonyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(2-hydroxycyclohexane-1-carbonyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 893.18 C28H46N7O18P3S
LMFA07050183 2-hydroxyglutaryl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(4-carboxy-2-hydroxybutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 897.14 C26H42N7O20P3S
LMFA07050184 2-hydroxypalmitoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(2-hydroxyhexadecanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1021.34 C37H66N7O18P3S
LMFA07050186 2-hydroxystearoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(2-hydroxyoctadecanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1049.37 C39H70N7O18P3S
LMFA07050187 2-hydroxytetracosanoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(2-hydroxytetracosanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 1133.46 C45H82N7O18P3S
LMFA07050190 2-methylbutanoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methylbutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 851.17 C26H44N7O17P3S
LMFA07050191 2-methylcrotonoyl-CoA 2-methyl-2E-butenoyl-CoA Fatty esters [FA07] Fatty acyl CoAs [FA0705] 849.16 C26H42N7O17P3S
LMFA07050193 2-oxocyclohexane-1-carbonyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(2-oxocyclohexane-1-carbonyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate} Fatty esters [FA07] Fatty acyl CoAs [FA0705] 891.17 C28H44N7O18P3S
LMFA07050194 2-oxoglutaryl-CoA 5'-O-[{[(4-{[3-({2-[(4-carboxy-2-oxobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutoxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]adenosine 3'-(dihydrogen phosphate) Fatty esters [FA07] Fatty acyl CoAs [FA0705] 895.13 C26H40N7O20P3S