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LM_ID
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Common Name
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Systematic Name
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Species Shorthand
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Formula
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Mass
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LMFA07050353
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N-methylanthraniloyl-CoA
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N-methylanthraniloyl-CoA
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C29H43N8O17P3S
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900.167983
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LMFA07050354
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nonanoyl-CoA
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3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-[(3-{[2-(nonanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-4-oxobutyl} dihydrogen diphosphate)
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CoA 9:0
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C30H52N7O17P3S
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907.235334
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LMFA07050355
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Octanoyl-CoA
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{[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
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CoA 8:0
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C29H50N7O17P3S
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893.219684
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LMFA07050356
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oleoyl-CoA
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9Z-octadecenoyl-CoA
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CoA 18:1
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C39H68N7O17P3S
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1031.360534
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LMFA07050357
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oxalyl-CoA
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3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-[(3-{[2-(oxalylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-4-oxobutyl} dihydrogen diphosphate)
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CoA 2:1;O2
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C23H36N7O19P3S
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839.099964
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LMFA07050358
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Palmitelaidoyl-CoA
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9E-hexadecenoyl-CoA
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CoA 16:1
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C37H64N7O17P3S
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1003.329234
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LMFA07050359
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palmitoleoyl-CoA
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9Z-hexadecenoyl-CoA
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CoA 16:1
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C37H64N7O17P3S
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1003.329234
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LMFA07050360
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Palmitoyl-CoA
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Hexadecanoyl-CoA
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CoA 16:0
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C37H66N7O17P3S
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1005.344884
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LMFA07050361
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pent-2-enoyl-CoA
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3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-(pent-2-enoylsulfanyl)ethyl]amino}propyl)amino]butyl}dihydrogen diphosphate)
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CoA 5:1
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C26H42N7O17P3S
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849.157084
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LMFA07050362
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pentanoyl-CoA
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3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-(pentanoylsulfanyl)ethyl]amino}propyl)amino]butyl} dihydrogen diphosphate)
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CoA 5:0
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C26H44N7O17P3S
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851.172734
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LMFA07050363
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pimeloyl-CoA
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3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(6-carboxyhexanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
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CoA 7:1;O2
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C28H46N7O19P3S
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909.178214
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LMFA07050364
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Propionyl-CoA
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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)
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CoA 3:0
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C24H40N7O17P3S
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823.141434
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LMFA07050365
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Pseudoecgonyl-CoA
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{[(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
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C30H49N8O18P3S
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934.209848
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LMFA07050366
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S-(5-Hydroxy-2-furoyl)-CoA
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[[(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
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CoA 5:3;O2
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C26H38N7O19P3S
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877.115614
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LMFA07050368
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sinapoyl-CoA
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3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
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CoA 11:5;O3
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C32H46N7O20P3S
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973.173129
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LMFA07050369
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Stearoyl-CoA
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Octadecanoyl-CoA
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CoA 18:0
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C39H70N7O17P3S
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1033.376184
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LMFA07050370
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Succinyl-CoA
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3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3-carboxypropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
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CoA 4:1;O2
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C25H40N7O19P3S
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867.131264
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LMFA07050371
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sulfoacetyl-CoA
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3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-[(3-{[2-(sulfoacetylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-4-oxobutyl} dihydrogen diphosphate)
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C23H38N7O20P3S2
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889.082601
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LMFA07050372
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Lignoceroyl-CoA
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Tetracosanoyl-CoA
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CoA 24:0
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C45H82N7O17P3S
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1117.470084
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LMFA07050375
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trans,cis-Lauro-2,5-dienoyl-CoA
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{[(2R,3R,5R)-5-(6-amino-9H-purin-9-yl)-2-({[({[(3R)-3-{[2-({2-[(2E,5Z)-dodeca-2,5-dienoylsulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}-3-hydroxy-2,2-dimethylpropoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]oxy}methyl)-4-hydroxyoxolan-3-yl]oxy}phosphonic acid
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CoA 12:2
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C33H54N7O17P3S
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945.250984
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LMFA07050376
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trans,trans-deca-2,4-dienoyl-CoA
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2E,4E-decadienoyl-CoA
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CoA 10:2
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C31H50N7O17P3S
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917.219684
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LMFA07050377
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trans,trans-octa-2,4-dienoyl-CoA
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2E,4E-octadienoyl-CoA
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CoA 8:2
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C29H46N7O17P3S
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889.188384
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LMFA07050378
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Trans-2,3-dehydrododecanoyl-CoA
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{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-2-{[({[(3-{[2-({2-[(2E)-dodec-2-enoylsulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}-3-hydroxy-2,2-dimethylpropoxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl)oxy]methyl}-4-hydroxyoxolan-3-yl]oxy}phosphonic acid
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CoA 12:1
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C33H56N7O17P3S
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947.266634
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LMFA07050379
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trans-2,3-didehydroadipoyl-CoA
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6-carboxy-2E-hexenoyl-CoA
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CoA 6:2;O2
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C27H42N7O19P3S
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893.146914
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LMFA07050380
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trans-2-Enoyl-OPC4-CoA
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CoA 14:4;O
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C35H54N7O18P3S
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985.245899
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LMFA07050381
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trans-2-Enoyl-OPC6-CoA
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CoA 16:4;O
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C37H58N7O18P3S
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1013.277199
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LMFA07050382
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trans-2-Enoyl-OPC8-CoA
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CoA 18:4;O
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C39H62N7O18P3S
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1041.308499
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LMFA07050383
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trans-2-hexacosenoyl-CoA
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(2E)-hexacos-2-enoyl-coenzyme A;3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(2E)-hexacos-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}
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CoA 26:1
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C47H84N7O17P3S
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1143.485734
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LMFA07050384
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cis-2-Methyl-5-isopropylhexa-2,5-dienoyl-CoA
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{[(2R,3R,5R)-5-(6-amino-9H-purin-9-yl)-2-({[({[(3R)-3-({2-[(2-{[(2Z)-2,6-dimethyl-5-methylidenehept-2-enoyl]sulfanyl}ethyl)carbamoyl]ethyl}carbamoyl)-3-hydroxy-2,2-dimethylpropoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]oxy}methyl)-4-hydroxyoxolan-3-yl]oxy}phosphonic acid
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CoA 10:2
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C31H50N7O17P3S
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917.219684
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LMFA07050385
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trans-2-octadecenoyl-CoA
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3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(2E)-octadec-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}
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CoA 18:1
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C39H68N7O17P3S
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1031.360534
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LMFA07050386
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trans-3-Decenoyl-CoA
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{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-2-({[({[(3R)-3-{[2-({2-[(3E)-dec-3-enoylsulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}-3-hydroxy-2,2-dimethylpropoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]oxy}methyl)-4-hydroxyoxolan-3-yl]oxy}phosphonic acid
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CoA 10:1
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C31H52N7O17P3S
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919.235334
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LMFA07050387
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trans-3-Hexenoyl-CoA
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{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-2-{[({[(3-{[2-({2-[(3E)-hex-3-enoylsulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}-3-hydroxy-2,2-dimethylpropoxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl)oxy]methyl}-4-hydroxyoxolan-3-yl]oxy}phosphonic acid
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CoA 6:1
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C27H44N7O17P3S
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863.172734
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LMFA07050388
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trans-3-methylglutaconyl-CoA
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(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
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CoA 6:2;O2
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C27H42N7O19P3S
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893.146914
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LMFA07050389
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trans-4-carboxybut-2-enoyl-CoA
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4-carboxy-2E-butenoyl-CoA
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CoA 5:2;O2
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C26H40N7O19P3S
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879.131264
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LMFA07050391
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trans-dec-2-enoyl-CoA
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3'-phosphoadenosine 5'-[3-(4-{[3-({2-[(2E)-dec-2-noylsulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl) dihydrogen diphosphate]
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CoA 10:1
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C31H52N7O17P3S
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919.235334
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LMFA07050392
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trans-feruloyl-CoA
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3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
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CoA 10:5;O2
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C31H44N7O19P3S
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943.162564
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LMFA07050393
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trans-hex-2-enoyl-CoA
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2E-hexenoyl-CoA
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CoA 6:1
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C27H44N7O17P3S
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863.172734
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LMFA07050394
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trans-oct-2-enoyl-CoA
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2E-octenoyl-CoA
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CoA 8:1
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C29H48N7O17P3S
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891.204034
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LMFA07050395
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trans-tetradec-11-enoyl-CoA
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11E-tetradecenoyl-CoA
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CoA 14:1
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C35H60N7O17P3S
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975.297934
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LMFA07050396
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trans-tetradec-2-enoyl-CoA
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2E-tetradecenoyl-CoA
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CoA 14:1
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C35H60N7O17P3S
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975.297934
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LMFA07050397
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Tridecanoyl-CoA
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{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({[hydroxy({3-hydroxy-2,2-dimethyl-3-[(2-{[2-(tridecanoylsulfanyl)ethyl]carbamoyl}ethyl)carbamoyl]propoxy})phosphoryl]oxy})phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid
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CoA 13:0
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C34H60N7O17P3S
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963.297934
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LMFA07050398
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Undecanoyl-CoA
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Undecanoyl-CoA
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CoA 11:0
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C32H56N7O17P3S
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935.266634
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LMFA07050399
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Valproyl-CoA
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{[(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-propylpentanoyl)sulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}propoxy)phosphoryl]oxy})phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid
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CoA 8:0
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C29H50N7O17P3S
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893.219684
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LMFA07050400
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vinylacetyl-CoA
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3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(but-3-enoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate)
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CoA 4:1
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C25H40N7O17P3S
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835.141434
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LMFA07010693
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(+/-)-Ethyl 2-hydroxy-2-methylbutyrate
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ethyl 2-hydroxy-2-methylbutanoate
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SFE 7:0;O
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C7H14O3
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146.094295
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LMFA07010694
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(+/-)-Ethyl 2-hydroxy-3-methylvalerate
|
ethyl 2-hydroxy-3-methylpentanoate
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SFE 8:0;O
|
C8H16O3
|
160.109945
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LMFA07010696
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(+/-)-Isobutyl 3-methylthiobutyrate
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2-methylpropyl 3-(methylsulfanyl)butanoate
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C9H18O2S
|
190.102752
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LMFA07010698
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(2E)-3-(methoxycarbonyl)pent-2-enedioic acid
|
(2E)-3-(methoxycarbonyl)pent-2-enedioic acid
|
WE 7:3;O4
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C7H8O6
|
188.032090
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LMFA07050367
|
Salicyl CoA
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{[(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
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887.136349
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LMFA07010699
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(2E,8Z)-Decadiene-4,6-diyn-1-yl 3-methylbutanoate
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(2E,8Z)-deca-2,8-dien-4,6-diyn-1-yl 3-methylbutanoate
|
WE 15:6
|
C15H18O2
|
230.130680
|