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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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LMFA07050171
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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
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CoA 22:7
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C43H64N7O17P3S
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1075.329234
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LMFA07050173
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2,6-dihydroxycyclohexane-1-carbonyl-CoA
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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}
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CoA 7:1;O2
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C28H46N7O19P3S
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909.178214
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LMFA07050174
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2-amino-5-oxocyclohex-1-enecarbonyl-CoA
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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}
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C28H43N8O18P3S
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904.162898
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LMFA07050176
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2E-Dodecenoyl-CoA
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3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E)-dodec-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
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CoA 12:1
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C33H56N7O17P3S
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947.266634
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LMFA07050177
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2-hydroxy-3-methylhexadecanoyl-CoA
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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)
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CoA 17:0;O
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C38H68N7O18P3S
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1035.355449
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LMFA07050178
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2-hydroxy-4-isopropenylcyclohexane-1-carbonyl-CoA
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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}
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CoA 10:2;O
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C31H50N7O18P3S
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933.214599
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LMFA07050179
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2-hydroxy-6-oxocyclohexane-1-carbonyl-CoA
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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}
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CoA 7:2;O2
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C28H44N7O19P3S
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907.162564
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LMFA07050180
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2-hydroxyadipoyl-CoA
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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}
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CoA 6:1;O3
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C27H44N7O20P3S
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911.157479
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LMFA07050181
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2-hydroxybehenoyl-CoA
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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}
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CoA 22:0;O
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C43H78N7O18P3S
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1105.433699
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LMFA07050182
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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}
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CoA 7:1;O
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C28H46N7O18P3S
|
893.183299
|
|
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}
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CoA 5:1;O3
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C26H42N7O20P3S
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897.141829
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|
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}
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CoA 16:0;O
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C37H66N7O18P3S
|
1021.339799
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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
|
CoA 20:0;O
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C41H74N7O18P3S
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1077.402399
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|
LMFA07050186
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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}
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CoA 18:0;O
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C39H70N7O18P3S
|
1049.371099
|
|
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}
|
CoA 24:0;O
|
C45H82N7O18P3S
|
1133.464999
|
|
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}
|
CoA 5:1;O
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C26H42N7O18P3S
|
865.151999
|
|
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}
|
CoA 5:0
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C26H44N7O17P3S
|
851.172734
|
|
LMFA07050191
|
2-methylcrotonoyl-CoA
|
2-methyl-2E-butenoyl-CoA
|
CoA 5:1
|
C26H42N7O17P3S
|
849.157084
|
|
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
|
CoA 7:0
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C28H48N7O17P3S
|
879.204034
|
|
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}
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CoA 7:2;O
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C28H44N7O18P3S
|
891.167649
|
|
LMFA07050194
|
2-oxoglutaryl-CoA
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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)
|
CoA 5:2;O3
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C26H40N7O20P3S
|
895.126179
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|
LMFA07050197
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3-(4-methylpent-3-en-1-yl)pent-2-enedioyl-CoA
|
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[7-methyl-3-(2-oxoethyl)octa-2,6-dienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}
|
CoA 11:3;O2
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C32H50N7O19P3S
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961.209514
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|
LMFA07050198
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3,4,4-trimethylhepta-2,5-dienoyl-CoA
|
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3,4,4-trimethylhepta-2,5-dien-1-yl)sulfanyl]ethyl}amino)propyl]amino}butyl]dihydrogen diphosphate}
|
CoA 10:3;O2
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C31H48N7O19P3S
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947.193864
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|
LMFA07050199
|
3,5,7-trioxododecanoyl-CoA
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3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-(3,5,7-trioxododecanoylsulfanyl)ethyl]amino}propyl)amino]butyl} dihydrogen diphosphate)
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CoA 12:3;O3
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C33H52N7O20P3S
|
991.220079
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|
LMFA07050200
|
3,8-dioxooct-5-enoyl-CoA
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3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[3,8-dioxooct-5-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
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CoA 8:3;O2
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C29H44N7O19P3S
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919.162564
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|
LMFA07050204
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3-aminobutyryl-CoA
|
3-aminobutanoyl-CoA
|
|
C25H43N8O17P3S
|
852.167983
|
|
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
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935.230249
|
|
LMFA07050206
|
3-hydroxy-2-methylpropanoyl-CoA
|
3'-phosphoadenosine 5'-[3-(3-hydroxy-4-{[3-({2-[(3-hydroxy-2-methylpropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl) dihydrogen diphosphate]
|
CoA 4:0;O
|
C25H42N7O18P3S
|
853.151999
|
|
LMFA07050207
|
3-hydroxy-3-(4-methylpent-3-en-1-yl)glutaryl-CoA
|
3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[3-(carboxymethyl)-3-hydroxy-7-methyloct-6-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
|
CoA 11:2;O3
|
C32H52N7O20P3S
|
979.220079
|
|
LMFA07050208
|
3-hydroxy-3-methylbutyl-CoA
|
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(3-hydroxy-3-methylbutyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl]dihydrogen diphosphate}
|
|
C26H46N7O17P3S
|
853.188384
|
|
LMFA07050209
|
3-hydroxy-3-methylglutaryl-CoA
|
3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(4-carboxy-3-hydroxy-3-methylbutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
|
CoA 6:1;O3
|
C27H44N7O20P3S
|
911.157479
|
|
LMFA07050210
|
3-hydroxy-5-oxohexanoyl-CoA
|
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(3-hydroxy-5-oxohexanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
|
CoA 6:1;O2
|
C27H44N7O19P3S
|
895.162564
|
|
LMFA07050211
|
3-hydroxyadipyl-CoA
|
3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(5-carboxy-3-hydroxypentanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
|
CoA 6:1;O3
|
C27H44N7O20P3S
|
911.157479
|
|
LMFA07050212
|
3-hydroxybutyryl-CoA
|
3-hydroxybutanoyl-CoA
|
CoA 4:0;O
|
C25H42N7O18P3S
|
853.151999
|
|
LMFA07050214
|
3-hydroxycyclohexa-1,5-diene-1-carbonyl-CoA
|
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(3-hydroxycyclohexa-1,5-diene-1-carbonyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
|
CoA 7:3;O
|
C28H42N7O18P3S
|
889.151999
|
|
LMFA07050215
|
3-hydroxydocosanoyl-CoA
|
3-hydroxydocosanoyl-CoA
|
CoA 22:0;O
|
C43H78N7O18P3S
|
1105.433699
|
|
LMFA07050216
|
3-hydroxyhexacosanoyl-CoA
|
3S-hydroxyhexacosanoyl-Co
|
CoA 26:0;O
|
C47H86N7O18P3S
|
1161.496299
|
|
LMFA07050217
|
3-Hydroxyhexdecanedioyl-CoA
|
16-{[2-(3-{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}-14-hydroxy-16-oxohexadecanoic acid
|
CoA 16:1;O3
|
C37H64N7O20P3S
|
1051.313979
|
|
LMFA07050218
|
3-hydroxyicosanoyl-CoA
|
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(3-hydroxyicosanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
|
CoA 20:0;O
|
C41H74N7O18P3S
|
1077.402399
|
|
LMFA07050219
|
3-hydroxyisoheptadecanoyl-CoA
|
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(3-hydroxy-15-methylhexadecanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
|
CoA 17:0;O
|
C38H68N7O18P3S
|
1035.355449
|
|
LMFA07050220
|
3-hydroxyisopentadecanoyl-CoA
|
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(3-hydroxy-13-methyltetradecanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
|
CoA 15:0;O
|
C36H64N7O18P3S
|
1007.324149
|
|
LMFA07050222
|
3-hydroxyisovaleryl-CoA
|
3-hydroxy-3-methyl-butanoyl-CoA
|
CoA 5:0;O
|
C26H44N7O18P3S
|
867.167649
|
|
LMFA07050223
|
3-hydroxyoctadecanoyl-CoA
|
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(3-hydroxyoctadecanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
|
CoA 18:0;O
|
C39H70N7O18P3S
|
1049.371099
|
|
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
|
|
LMFA07050225
|
3-hydroxypristanoyl-CoA
|
3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-(3-hydroxy-2,6,10,14-tetramethylpentadecanoylsulfanyl)ethyl]amino}propyl)amino]butyl} dihydrogen diphosphate)
|
CoA 19:0;O
|
C40H72N7O18P3S
|
1063.386749
|
|
LMFA07050226
|
3-hydroxypropionyl-CoA
|
3-hydroxypropanoyl-CoA
|
CoA 3:0;O
|
C24H40N7O18P3S
|
839.136349
|
|
LMFA07050228
|
3-hydroxytetracosanoyl-CoA
|
3-hydroxytetracosanoyl-CoA
|
CoA 24:0;O
|
C45H82N7O18P3S
|
1133.464999
|
|
LMFA07050229
|
3-isopropenylpimeloyl-CoA
|
3-isopropenyl-7-carboxy-heptanoyl-CoA
|
CoA 10:2;O2
|
C31H50N7O19P3S
|
949.209514
|
|
LMFA07050231
|
3-Isopropylbut-3-enoyl-CoA
|
S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-2-hydroxy-3,3-dimethyl-butanoyl]amino]propanoylamino]ethyl] 4-methyl-3-methylene-pentanethioate
|
CoA 7:1
|
C28H46N7O17P3S
|
877.188384
|
|
LMFA07050232
|
3-methylbut-2-enoyl-CoA
|
3-methyl-2-butenoyl-CoA
|
CoA 5:1
|
C26H42N7O17P3S
|
849.157084
|