Structure Database (LMSD)

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LMSD: Lipid classification search results

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Carbocyclic fatty acids [FA0114]

LM_ID Common Name Systematic Name Species Shorthand Formula Mass
LMFA07050368 sinapoyl-CoA 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} CoA 11:5;O3 C32H46N7O20P3S 973.173119
LMFA07050369 Stearoyl-CoA Octadecanoyl-CoA CoA 18:0 C39H70N7O17P3S 1033.376175
LMFA07050370 Succinyl-CoA 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} CoA 4:1;O2 C25H40N7O19P3S 867.131254
LMFA07050371 sulfoacetyl-CoA 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-[(3-{[2-(sulfoacetylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-4-oxobutyl} dihydrogen diphosphate) C23H38N7O20P3S2 889.082590
LMFA07050372 Lignoceroyl-CoA Tetracosanoyl-CoA CoA 24:0 C45H82N7O17P3S 1117.470075
LMFA07050375 trans,cis-Lauro-2,5-dienoyl-CoA {[(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 CoA 12:2 C33H54N7O17P3S 945.250974
LMFA07050376 trans,trans-deca-2,4-dienoyl-CoA 2E,4E-decadienoyl-CoA CoA 10:2 C31H50N7O17P3S 917.219674
LMFA07050377 trans,trans-octa-2,4-dienoyl-CoA 2E,4E-octadienoyl-CoA CoA 8:2 C29H46N7O17P3S 889.188374
LMFA07050378 Trans-2,3-dehydrododecanoyl-CoA {[(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 CoA 12:1 C33H56N7O17P3S 947.266624
LMFA07050379 trans-2,3-didehydroadipoyl-CoA 6-carboxy-2E-hexenoyl-CoA CoA 6:2;O2 C27H42N7O19P3S 893.146904
LMFA07050383 trans-2-hexacosenoyl-CoA (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} CoA 26:1 C47H84N7O17P3S 1143.485725
LMFA07050385 trans-2-octadecenoyl-CoA 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} CoA 18:1 C39H68N7O17P3S 1031.360525
LMFA07050386 trans-3-Decenoyl-CoA {[(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 CoA 10:1 C31H52N7O17P3S 919.235324
LMFA07050387 trans-3-Hexenoyl-CoA {[(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 CoA 6:1 C27H44N7O17P3S 863.172724
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 893.146904
LMFA07050389 trans-4-carboxybut-2-enoyl-CoA 4-carboxy-2E-butenoyl-CoA CoA 5:2;O2 C26H40N7O19P3S 879.131254
LMFA07050391 trans-dec-2-enoyl-CoA 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] CoA 10:1 C31H52N7O17P3S 919.235324
LMFA07050392 trans-feruloyl-CoA 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} CoA 10:5;O2 C31H44N7O19P3S 943.162554
LMFA07050393 trans-hex-2-enoyl-CoA 2E-hexenoyl-CoA CoA 6:1 C27H44N7O17P3S 863.172724
LMFA07050394 trans-oct-2-enoyl-CoA 2E-octenoyl-CoA CoA 8:1 C29H48N7O17P3S 891.204024
LMFA07050395 trans-tetradec-11-enoyl-CoA 11E-tetradecenoyl-CoA CoA 14:1 C35H60N7O17P3S 975.297925
LMFA07050396 trans-tetradec-2-enoyl-CoA 2E-tetradecenoyl-CoA CoA 14:1 C35H60N7O17P3S 975.297925
LMFA07050397 Tridecanoyl-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-(tridecanoylsulfanyl)ethyl]carbamoyl}ethyl)carbamoyl]propoxy})phosphoryl]oxy})phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid CoA 13:0 C34H60N7O17P3S 963.297925
LMFA07050398 Undecanoyl-CoA Undecanoyl-CoA CoA 11:0 C32H56N7O17P3S 935.266624
LMFA07050399 Valproyl-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-propylpentanoyl)sulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}propoxy)phosphoryl]oxy})phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid CoA 8:0 C29H50N7O17P3S 893.219674
LMFA07050400 vinylacetyl-CoA 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) CoA 4:1 C25H40N7O17P3S 835.141424
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 887.136339
LMFA07010743 2-Propenyl cyclohexanebutanoate prop-2-en-1-yl 4-cyclohexylbutanoate WE 13:2 C13H22O2 210.161980
LMFA07010744 2-Propenyl cyclohexanehexanoate prop-2-en-1-yl 6-cyclohexylhexanoate WE 15:2 C15H26O2 238.193280
LMFA07010745 2-Propenyl cyclohexanepentanoate prop-2-en-1-yl 5-cyclohexylpentanoate WE 14:2 C14H24O2 224.177630
LMFA07010775 Allyl 3-cyclohexylpropionate prop-2-en-1-yl 3-cyclohexylpropanoate WE 12:2 C12H20O2 196.146330
LMFA07010813 Citronellyl alpha-toluate 3,7-dimethyloct-6-en-1-yl 2-phenylacetate WE 18:5 C18H26O2 274.193280
LMFA07010815 Citronellyl cinnamate 3,7-dimethyloct-6-en-1-yl (2E)-3-phenylprop-2-enoate WE 19:6 C19H26O2 286.193280
LMFA07010823 Cyclohexyl 3-methylbutanoate cyclohexyl 3-methylbutanoate WE 11:1 C11H20O2 184.146330
LMFA07010824 Cyclohexyl butanoate cyclohexyl butanoate WE 10:1 C10H18O2 170.130680
LMFA07010825 Cyclohexyl pentanoate cyclohexyl pentanoate WE 11:1 C11H20O2 184.146330
LMFA07010853 Ethyl 2-ethyl-3-phenylpropanoate ethyl 2-benzylbutanoate SFE 13:4 C13H18O2 206.130680
LMFA07010862 Ethyl 3-cyclohexylpropionate ethyl 3-cyclohexylpropanoate SFE 11:1 C11H20O2 184.146330
LMFA07010871 Ethyl 4-phenylbutanoate ethyl 4-phenylbutanoate SFE 12:4 C12H16O2 192.115030
LMFA07010951 Methyl 3-phenylpropanoate methyl 3-phenylpropanoate SFE 10:4 C10H12O2 164.083730
LMFA07010955 Methyl 4-phenylbutanoate methyl 4-phenylbutanoate SFE 11:4 C11H14O2 178.099380
LMFA07010982 Octyl phenylacetate octyl 2-phenylacetate SFE 16:4 C16H24O2 248.177630
LMFA07011015 Rhodinyl phenylacetate 3,7-dimethyloct-7-en-1-yl 2-phenylacetate SFE 18:5 C18H26O2 274.193280
LMFA07011017 Sorbitan laurate 2-(3,4-dihydroxyoxolan-2-yl)-2-hydroxyethyl dodecanoate WE 18:1;O4 C18H34O6 346.235541
LMFA07011018 Sorbitan oleate 2-(3,4-dihydroxyoxolan-2-yl)-2-hydroxyethyl (9E)-octadec-9-enoate WE 24:2;O4 C24H44O6 428.313791
LMFA07011019 Sorbitan palmitate 2-(3,4-dihydroxyoxolan-2-yl)-2-hydroxyethyl hexadecanoate WE 22:1;O4 C22H42O6 402.298141
LMFA07011020 Sorbitan stearate 2-(3,4-dihydroxyoxolan-2-yl)-2-hydroxyethyl octadecanoate WE 24:1;O4 C24H46O6 430.329441
LMFA01140028 11-Phenylundecanoic acid 11-Phenylundecanoic acid FA 17:4 C17H26O2 262.193280
LMFA01140029 Dihydroxychaulmoogric acid Dihydroxy-2-cyclopentene-1-tridecanoic acid FA 18:2;O2 C18H32O4 312.230061
LMFA01140030 15-Phenylpentadecanoic acid 15-Phenylpentadecanoic acid FA 21:4 C21H34O2 318.255881