|
LM_ID
|
Common Name
|
Systematic Name
|
Species Shorthand
|
Formula
|
Mass
|
|
LMFA07050191
|
2-methylcrotonoyl-CoA
|
2-methyl-2E-butenoyl-CoA
|
CoA 5:1
|
C26H42N7O17P3S
|
849.157074
|
|
LMFA07050191
|
2-methylcrotonoyl-CoA
|
2-methyl-2E-butenoyl-CoA
|
CoA 5:1
|
C26H42N7O17P3S
|
849.157074
|
|
LMFA07050191
|
2-methylcrotonoyl-CoA
|
2-methyl-2E-butenoyl-CoA
|
CoA 5:1
|
C26H42N7O17P3S
|
849.157074
|
|
LMFA07050191
|
2-methylcrotonoyl-CoA
|
2-methyl-2E-butenoyl-CoA
|
CoA 5:1
|
C26H42N7O17P3S
|
849.157074
|
|
LMFA07050191
|
2-methylcrotonoyl-CoA
|
2-methyl-2E-butenoyl-CoA
|
CoA 5:1
|
C26H42N7O17P3S
|
849.157074
|
|
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
|
C28H48N7O17P3S
|
879.204024
|
|
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
|
C28H48N7O17P3S
|
879.204024
|
|
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
|
C28H48N7O17P3S
|
879.204024
|
|
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
|
C28H48N7O17P3S
|
879.204024
|
|
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
|
C28H48N7O17P3S
|
879.204024
|
|
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}
|
CoA 7:2;O
|
C28H44N7O18P3S
|
891.167639
|
|
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}
|
CoA 7:2;O
|
C28H44N7O18P3S
|
891.167639
|
|
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}
|
CoA 7:2;O
|
C28H44N7O18P3S
|
891.167639
|
|
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}
|
CoA 7:2;O
|
C28H44N7O18P3S
|
891.167639
|
|
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}
|
CoA 7:2;O
|
C28H44N7O18P3S
|
891.167639
|
|
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}
|
CoA 7:2;O
|
C28H44N7O18P3S
|
891.167639
|
|
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)
|
CoA 5:2;O3
|
C26H40N7O20P3S
|
895.126169
|
|
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)
|
CoA 5:2;O3
|
C26H40N7O20P3S
|
895.126169
|
|
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)
|
CoA 5:2;O3
|
C26H40N7O20P3S
|
895.126169
|
|
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)
|
CoA 5:2;O3
|
C26H40N7O20P3S
|
895.126169
|
|
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)
|
CoA 5:2;O3
|
C26H40N7O20P3S
|
895.126169
|
|
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)
|
CoA 5:2;O3
|
C26H40N7O20P3S
|
895.126169
|
|
LMFA07050197
|
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
|
C32H50N7O19P3S
|
961.209504
|
|
LMFA07050197
|
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
|
C32H50N7O19P3S
|
961.209504
|
|
LMFA07050197
|
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
|
C32H50N7O19P3S
|
961.209504
|
|
LMFA07050197
|
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
|
C32H50N7O19P3S
|
961.209504
|
|
LMFA07050197
|
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
|
C32H50N7O19P3S
|
961.209504
|
|
LMFA07050198
|
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
|
C31H48N7O19P3S
|
947.193854
|
|
LMFA07050198
|
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
|
C31H48N7O19P3S
|
947.193854
|
|
LMFA07050198
|
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
|
C31H48N7O19P3S
|
947.193854
|
|
LMFA07050198
|
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
|
C31H48N7O19P3S
|
947.193854
|
|
LMFA07050198
|
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
|
C31H48N7O19P3S
|
947.193854
|
|
LMFA07050199
|
3,5,7-trioxododecanoyl-CoA
|
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)
|
CoA 12:3;O3
|
C33H52N7O20P3S
|
991.220069
|
|
LMFA07050199
|
3,5,7-trioxododecanoyl-CoA
|
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)
|
CoA 12:3;O3
|
C33H52N7O20P3S
|
991.220069
|
|
LMFA07050199
|
3,5,7-trioxododecanoyl-CoA
|
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)
|
CoA 12:3;O3
|
C33H52N7O20P3S
|
991.220069
|
|
LMFA07050199
|
3,5,7-trioxododecanoyl-CoA
|
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)
|
CoA 12:3;O3
|
C33H52N7O20P3S
|
991.220069
|
|
LMFA07050199
|
3,5,7-trioxododecanoyl-CoA
|
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)
|
CoA 12:3;O3
|
C33H52N7O20P3S
|
991.220069
|
|
LMFA07050199
|
3,5,7-trioxododecanoyl-CoA
|
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)
|
CoA 12:3;O3
|
C33H52N7O20P3S
|
991.220069
|
|
LMFA07050200
|
3,8-dioxooct-5-enoyl-CoA
|
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}
|
CoA 8:3;O2
|
C29H44N7O19P3S
|
919.162554
|
|
LMFA07050200
|
3,8-dioxooct-5-enoyl-CoA
|
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}
|
CoA 8:3;O2
|
C29H44N7O19P3S
|
919.162554
|
|
LMFA07050200
|
3,8-dioxooct-5-enoyl-CoA
|
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}
|
CoA 8:3;O2
|
C29H44N7O19P3S
|
919.162554
|
|
LMFA07050200
|
3,8-dioxooct-5-enoyl-CoA
|
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}
|
CoA 8:3;O2
|
C29H44N7O19P3S
|
919.162554
|
|
LMFA07050200
|
3,8-dioxooct-5-enoyl-CoA
|
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}
|
CoA 8:3;O2
|
C29H44N7O19P3S
|
919.162554
|
|
LMFA07050200
|
3,8-dioxooct-5-enoyl-CoA
|
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}
|
CoA 8:3;O2
|
C29H44N7O19P3S
|
919.162554
|
|
LMFA07050204
|
3-aminobutyryl-CoA
|
3-aminobutanoyl-CoA
|
|
C25H43N8O17P3S
|
852.167973
|
|
LMFA07050204
|
3-aminobutyryl-CoA
|
3-aminobutanoyl-CoA
|
|
C25H43N8O17P3S
|
852.167973
|
|
LMFA07050204
|
3-aminobutyryl-CoA
|
3-aminobutanoyl-CoA
|
|
C25H43N8O17P3S
|
852.167973
|
|
LMFA07050204
|
3-aminobutyryl-CoA
|
3-aminobutanoyl-CoA
|
|
C25H43N8O17P3S
|
852.167973
|
|
LMFA07050204
|
3-aminobutyryl-CoA
|
3-aminobutanoyl-CoA
|
|
C25H43N8O17P3S
|
852.167973
|
|
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
|
935.230239
|