Structure Database (LMSD)

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LMSD: Lipid classification search results

Fatty acyl CoAs [FA0705]

LM_ID Common Name Systematic Name Species Shorthand Formula Mass
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 C26H44N7O17P3S 851.172724
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
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
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
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
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
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 853.151989
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 979.220069
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 853.188374
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 911.157469
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 895.162554
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 911.157469
LMFA07050212 3-hydroxybutyryl-CoA 3-hydroxybutanoyl-CoA CoA 4:0;O C25H42N7O18P3S 853.151989
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 889.151989
LMFA07050215 3-hydroxydocosanoyl-CoA 3-hydroxydocosanoyl-CoA CoA 22:0;O C43H78N7O18P3S 1105.433690
LMFA07050216 3-hydroxyhexacosanoyl-CoA 3S-hydroxyhexacosanoyl-Co CoA 26:0;O C47H86N7O18P3S 1161.496290
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 1051.313970
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 1077.402390
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 1035.355440
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 1007.324140
LMFA07050222 3-hydroxyisovaleryl-CoA 3-hydroxy-3-methyl-butanoyl-CoA CoA 5:0;O C26H44N7O18P3S 867.167639
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 1049.371090
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 925.173119
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 1063.386740
LMFA07050226 3-hydroxypropionyl-CoA 3-hydroxypropanoyl-CoA CoA 3:0;O C24H40N7O18P3S 839.136339
LMFA07050228 3-hydroxytetracosanoyl-CoA 3-hydroxytetracosanoyl-CoA CoA 24:0;O C45H82N7O18P3S 1133.464990
LMFA07050229 3-isopropenylpimeloyl-CoA 3-isopropenyl-7-carboxy-heptanoyl-CoA CoA 10:2;O2 C31H50N7O19P3S 949.209504
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 877.188374
LMFA07050232 3-methylbut-2-enoyl-CoA 3-methyl-2-butenoyl-CoA CoA 5:1 C26H42N7O17P3S 849.157074
LMFA07050233 3-methylbut-3-enoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(3-methylbut-3-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate} CoA 5:1 C26H42N7O17P3S 849.157074
LMFA07050236 3-oxo-8-carboxy-5-octenoyl-CoA 3-oxo-5,6-dehydrosuberyl-CoA CoA 8:3;O3 C29H44N7O20P3S 935.157469
LMFA07050237 3-oxoadipyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(5-carboxy-3-oxopentanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} CoA 6:2;O3 C27H42N7O20P3S 909.141819
LMFA07050239 3-oxodecanoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxodecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate} CoA 10:1;O C31H52N7O18P3S 935.230239
LMFA07050240 3-ketodocosanoyl-CoA 3-oxodocosanoyl-CoA CoA 22:1;O C43H76N7O18P3S 1103.418040
LMFA07050241 3-ketocerotoyl-CoA 3-oxohexacosanoyl-CoA CoA 26:1;O C47H84N7O18P3S 1159.480640
LMFA07050242 3-Ketohexanoyl-CoA 3-Oxohexanoyl-CoA CoA 6:1;O C27H44N7O18P3S 879.167639
LMFA07050243 3-ketoeicosanoyl-CoA 3-oxoeicosanoyl-CoA CoA 20:1;O C41H72N7O18P3S 1075.386740
LMFA07050244 3-oxoisoheptadecanoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(13-methyl-3-oxohexadecanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} CoA 17:1;O C38H66N7O18P3S 1033.339790
LMFA07050245 3-oxoisooctadecanoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(16-methyl-3-oxoheptadecanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} CoA 18:1;O C39H68N7O18P3S 1047.355440
LMFA07050246 3-oxoisopentadecanoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(13-methyl-3-oxotetradecanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} CoA 15:1;O C36H62N7O18P3S 1005.308490
LMFA07050248 3-oxooctadecanoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxooctadecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate} CoA 18:1;O C39H68N7O18P3S 1047.355440
LMFA07050249 3-Oxooctanoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxooctanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate} CoA 8:1;O C29H48N7O18P3S 907.198939
LMFA07050250 3-ketopalmitoyl-CoA 3-oxohexadecanoyl-CoA CoA 16:1;O C37H64N7O18P3S 1019.324140
LMFA07050251 3-oxopimeloyl-CoA 3-oxo-7-carboxy-heptanoyl-CoA CoA 7:2;O3 C28H44N7O20P3S 923.157469
LMFA07050253 3-oxopristanoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(2,6,10,14-tetramethyl-3-oxopentadecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate} CoA 19:1;O C40H70N7O18P3S 1061.371090