Structure Database (LMSD)

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LMSD: Lipid classification search results

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Fatty Acyls [FA]

LM_ID Common Name Systematic Name Species Shorthand Formula Mass
LMFA07050305 cis-tetradec-5-enoyl-CoA 5Z-tetradecenoyl-CoA CoA 14:1 C35H60N7O17P3S 975.297934
LMFA07050305 cis-tetradec-5-enoyl-CoA 5Z-tetradecenoyl-CoA CoA 14:1 C35H60N7O17P3S 975.297934
LMFA07050305 cis-tetradec-5-enoyl-CoA 5Z-tetradecenoyl-CoA CoA 14:1 C35H60N7O17P3S 975.297934
LMFA07050305 cis-tetradec-5-enoyl-CoA 5Z-tetradecenoyl-CoA CoA 14:1 C35H60N7O17P3S 975.297934
LMFA07050305 cis-tetradec-5-enoyl-CoA 5Z-tetradecenoyl-CoA CoA 14:1 C35H60N7O17P3S 975.297934
LMFA07050305 cis-tetradec-5-enoyl-CoA 5Z-tetradecenoyl-CoA CoA 14:1 C35H60N7O17P3S 975.297934
LMFA07050319 feruloyl-CoA(4-) 3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] diphosphate} CoA 10:7;O2 C31H40N7O19P3S 939.131264
LMFA07050319 feruloyl-CoA(4-) 3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] diphosphate} CoA 10:7;O2 C31H40N7O19P3S 939.131264
LMFA07050319 feruloyl-CoA(4-) 3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] diphosphate} CoA 10:7;O2 C31H40N7O19P3S 939.131264
LMFA07050319 feruloyl-CoA(4-) 3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] diphosphate} CoA 10:7;O2 C31H40N7O19P3S 939.131264
LMFA07050319 feruloyl-CoA(4-) 3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] diphosphate} CoA 10:7;O2 C31H40N7O19P3S 939.131264
LMFA07050319 feruloyl-CoA(4-) 3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] diphosphate} CoA 10:7;O2 C31H40N7O19P3S 939.131264
LMFA07050319 feruloyl-CoA(4-) 3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] diphosphate} CoA 10:7;O2 C31H40N7O19P3S 939.131264
LMFA07050330 indol-3-ylacetyl-CoA 3'-phosphoadenosine 5'-[3-(3-hydroxy-4-{[3-({2-[(1H-indol-3-ylacetyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl) dihydrogen diphosphate] C31H43N8O17P3S 924.167983
LMFA07050330 indol-3-ylacetyl-CoA 3'-phosphoadenosine 5'-[3-(3-hydroxy-4-{[3-({2-[(1H-indol-3-ylacetyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl) dihydrogen diphosphate] C31H43N8O17P3S 924.167983
LMFA07050330 indol-3-ylacetyl-CoA 3'-phosphoadenosine 5'-[3-(3-hydroxy-4-{[3-({2-[(1H-indol-3-ylacetyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl) dihydrogen diphosphate] C31H43N8O17P3S 924.167983
LMFA07050330 indol-3-ylacetyl-CoA 3'-phosphoadenosine 5'-[3-(3-hydroxy-4-{[3-({2-[(1H-indol-3-ylacetyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl) dihydrogen diphosphate] C31H43N8O17P3S 924.167983
LMFA07050330 indol-3-ylacetyl-CoA 3'-phosphoadenosine 5'-[3-(3-hydroxy-4-{[3-({2-[(1H-indol-3-ylacetyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl) dihydrogen diphosphate] C31H43N8O17P3S 924.167983
LMFA07050330 indol-3-ylacetyl-CoA 3'-phosphoadenosine 5'-[3-(3-hydroxy-4-{[3-({2-[(1H-indol-3-ylacetyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl) dihydrogen diphosphate] C31H43N8O17P3S 924.167983
LMFA01140116 CVCL3 7-(2-Buta-1Z-enyl-phenyl)-hepta-3E,5E-dienoic acid FA 16:7 C16H18O2 242.130680
LMFA01140116 CVCL3 7-(2-Buta-1Z-enyl-phenyl)-hepta-3E,5E-dienoic acid FA 16:7 C16H18O2 242.130680
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} CoA 5:0 C26H44N7O17P3S 851.172734
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} CoA 5:0 C26H44N7O17P3S 851.172734
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} CoA 5:0 C26H44N7O17P3S 851.172734
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} CoA 5:0 C26H44N7O17P3S 851.172734
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} CoA 5:0 C26H44N7O17P3S 851.172734
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} CoA 5:0 C26H44N7O17P3S 851.172734
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 CoA 7:4;O C28H40N7O18P3S 887.136349
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 CoA 7:4;O C28H40N7O18P3S 887.136349
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 CoA 7:4;O C28H40N7O18P3S 887.136349
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 CoA 7:4;O C28H40N7O18P3S 887.136349
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 CoA 7:4;O C28H40N7O18P3S 887.136349
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 CoA 7:4;O C28H40N7O18P3S 887.136349
LMFA07050381 trans-2-Enoyl-OPC6-CoA CoA 16:4;O C37H58N7O18P3S 1013.277199
LMFA07050381 trans-2-Enoyl-OPC6-CoA CoA 16:4;O C37H58N7O18P3S 1013.277199
LMFA07050381 trans-2-Enoyl-OPC6-CoA CoA 16:4;O C37H58N7O18P3S 1013.277199
LMFA07050381 trans-2-Enoyl-OPC6-CoA CoA 16:4;O C37H58N7O18P3S 1013.277199
LMFA07050381 trans-2-Enoyl-OPC6-CoA CoA 16:4;O C37H58N7O18P3S 1013.277199
LMFA07050381 trans-2-Enoyl-OPC6-CoA CoA 16:4;O C37H58N7O18P3S 1013.277199
LMFA07050388 trans-3-methylglutaconyl-CoA (E)-5-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethylsulfanyl]-3-methyl-5-oxopent-3-enoic acid CoA 6:2;O2 C27H42N7O19P3S 893.146914
LMFA07050388 trans-3-methylglutaconyl-CoA (E)-5-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethylsulfanyl]-3-methyl-5-oxopent-3-enoic acid CoA 6:2;O2 C27H42N7O19P3S 893.146914
LMFA07050388 trans-3-methylglutaconyl-CoA (E)-5-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethylsulfanyl]-3-methyl-5-oxopent-3-enoic acid CoA 6:2;O2 C27H42N7O19P3S 893.146914
LMFA07050388 trans-3-methylglutaconyl-CoA (E)-5-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethylsulfanyl]-3-methyl-5-oxopent-3-enoic acid CoA 6:2;O2 C27H42N7O19P3S 893.146914
LMFA07050388 trans-3-methylglutaconyl-CoA (E)-5-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethylsulfanyl]-3-methyl-5-oxopent-3-enoic acid CoA 6:2;O2 C27H42N7O19P3S 893.146914
LMFA07050388 trans-3-methylglutaconyl-CoA (E)-5-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethylsulfanyl]-3-methyl-5-oxopent-3-enoic acid CoA 6:2;O2 C27H42N7O19P3S 893.146914
LMFA07070003 O-butanoyl-carnitine O-butanoyl-carnitine CAR 4:0 C11H21NO4 231.147059
LMFA07070004 Palmitoylcarnitine O-hexadecanoyl-R-carnitine CAR 16:0 C23H45NO4 399.334859
LMFA07070005 O-propanoyl-carnitine O-propanoyl-carnitine CAR 3:0 C10H19NO4 217.131409
LMFA07070025 (9Z)-3-hydroxyoctadecenoylcarnitine 3-{[(9Z)-3-hydroxyoctadec-9-enoyl]oxy}-4-(trimethylazaniumyl)butanoate CAR 18:1;O C25H47NO5 441.345424
LMFA07070025 (9Z)-3-hydroxyoctadecenoylcarnitine 3-{[(9Z)-3-hydroxyoctadec-9-enoyl]oxy}-4-(trimethylazaniumyl)butanoate CAR 18:1;O C25H47NO5 441.345424