Structure Database (LMSD)

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LMSD: Lipid classification search results

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Fatty esters [FA07]

LM_ID Common Name Systematic Name Species Shorthand Formula Mass
LMFA07050304 cis-tetradec-3-enoyl-CoA 3Z-tetradecenoyl-CoA CoA 14:1 C35H60N7O17P3S 975.297934
LMFA07050305 cis-tetradec-5-enoyl-CoA 5Z-tetradecenoyl-CoA CoA 14:1 C35H60N7O17P3S 975.297934
LMFA07050310 cyclohexa-1,5-diene-1-carbonyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(cyclohexa-1,5-diene-1-carbonyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} CoA 7:3 C28H42N7O17P3S 873.157084
LMFA07050319 feruloyl-CoA(4-) 3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] diphosphate} CoA 10:7;O2 C31H40N7O19P3S 939.131264
LMFA07050321 gamma-butyrobetainyl-CoA 4-trimethylammoniobutanoyl-CoA C28H50N8O17P3S 895.222758
LMFA07050325 Heptadecanoyl CoA {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-2-({[({[(3R)-3-[(2-{[2-(heptadecanoylsulfanyl)ethyl]carbamoyl}ethyl)carbamoyl]-3-hydroxy-2,2-dimethylpropoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]oxy}methyl)-4-hydroxyoxolan-3-yl]oxy}phosphonic acid CoA 17:0 C38H68N7O17P3S 1019.360534
LMFA07050326 Enanthyl-CoA Heptanoyl-CoA CoA 7:0 C28H48N7O17P3S 879.204034
LMFA07050331 Isobutyryl-CoA {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-2,2-dimethyl-3-{[2-({2-[(2-methylpropanoyl)sulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}propoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid CoA 4:0 C25H42N7O17P3S 837.157084
LMFA07050335 isotridecanoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(11-methyldodecanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} CoA 13:0 C34H60N7O17P3S 963.297934
LMFA07050336 Isovaleryl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(3-methylbutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate} CoA 5:0 C26H44N7O17P3S 851.172734
LMFA07050340 Lauroyl-CoA Dodecanoyl-CoA CoA 12:0 C33H58N7O17P3S 949.282284
LMFA07050343 Linoleoyl-CoA 9Z-12Z-octadecadienoyl-CoA CoA 18:2 C39H66N7O17P3S 1029.344884
LMFA07050344 malonamoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3-amino-3-oxopropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} C24H39N8O18P3S 852.131598
LMFA07050345 Malonyl-CoA Malonyl CoA CoA 3:1;O2 C24H38N7O19P3S 853.115614
LMFA07050347 Malonyl-CoA semialdehyde 3-Oxopropanoyl-CoA CoA 3:1;O C24H38N7O18P3S 837.120699
LMFA07050348 Malyl-CoA (2S)-4-{[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}-2-hydroxy-4-oxobutanoic acid CoA 4:1;O3 C25H40N7O20P3S 883.126179
LMFA07050350 Methacrylyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methylprop-2-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate} CoA 4:1 C25H40N7O17P3S 835.141434
LMFA07050355 Octanoyl-CoA {[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 CoA 8:0 C29H50N7O17P3S 893.219684
LMFA07050358 Palmitelaidoyl-CoA 9E-hexadecenoyl-CoA CoA 16:1 C37H64N7O17P3S 1003.329234
LMFA07050361 pent-2-enoyl-CoA 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) CoA 5:1 C26H42N7O17P3S 849.157084
LMFA07050364 Propionyl-CoA 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) CoA 3:0 C24H40N7O17P3S 823.141434
LMFA07050377 trans,trans-octa-2,4-dienoyl-CoA 2E,4E-octadienoyl-CoA CoA 8:2 C29H46N7O17P3S 889.188384
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 947.266634
LMFA07050382 trans-2-Enoyl-OPC8-CoA CoA 18:4;O C39H62N7O18P3S 1041.308499
LMFA07050384 cis-2-Methyl-5-isopropylhexa-2,5-dienoyl-CoA {[(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 CoA 10:2 C31H50N7O17P3S 917.219684
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 1031.360534
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 919.235334
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 893.146914
LMFA07050389 trans-4-carboxybut-2-enoyl-CoA 4-carboxy-2E-butenoyl-CoA CoA 5:2;O2 C26H40N7O19P3S 879.131264
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 919.235334
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 943.162564
LMFA07050396 trans-tetradec-2-enoyl-CoA 2E-tetradecenoyl-CoA CoA 14:1 C35H60N7O17P3S 975.297934
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 963.297934
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 893.219684
LMFA07010699 (2E,8Z)-Decadiene-4,6-diyn-1-yl 3-methylbutanoate (2E,8Z)-deca-2,8-dien-4,6-diyn-1-yl 3-methylbutanoate WE 15:6 C15H18O2 230.130680
LMFA07010705 (Z)-8-Decene-4,6-diyn-1-yl 3-methylbutanoate (8Z)-dec-8-en-4,6-diyn-1-yl 3-methylbutanoate WE 15:5 C15H20O2 232.146330
LMFA07010710 1-Ethenylhexyl butanoate oct-1-en-3-yl butanoate WE 12:1 C12H22O2 198.161980
LMFA07010714 2-Furanylmethyl butanoate furan-2-ylmethyl butanoate WE 9:3;O C9H12O3 168.078645
LMFA07010716 2-Hexenoylcholine {2-[(2E)-hex-2-enoyloxy]ethyl}trimethylazanium C11H22NO2 200.165054
LMFA07010717 2-Hexenyl isovalerate (2E)-hex-2-en-1-yl 3-methylbutanoate WE 11:1 C11H20O2 184.146330
LMFA07010718 2-Hexenyl octanoate (2E)-hex-2-en-1-yl octanoate WE 14:1 C14H26O2 226.193280
LMFA07010719 2-Hexenyl valerate (2E)-hex-2-en-1-yl pentanoate WE 11:1 C11H20O2 184.146330
LMFA07010726 2-Methylpropyl (2E)-butenoate 2-methylpropyl (2Z)-but-2-enoate WE 8:1 C8H14O2 142.099380
LMFA07010729 2-Methylpropyl hexanoate 2-methylpropyl hexanoate WE 10:0 C10H20O2 172.146330
LMFA07010741 2-Propenyl 2-ethylbutanoate prop-2-en-1-yl 2-ethylbutanoate WE 9:1 C9H16O2 156.115030
LMFA07010742 2-Propenyl 3-methylbutanoate prop-2-en-1-yl 3-methylbutanoate WE 8:1 C8H14O2 142.099380
LMFA07010713 2-Decene-4,6-diynoic acid, methyl ester, (E)- methyl (E)-dec-2-en-4,6-diynoate SFE 11:5 C11H12O2 176.083730
LMFA07010693 (+/-)-Ethyl 2-hydroxy-2-methylbutyrate ethyl 2-hydroxy-2-methylbutanoate SFE 7:0;O C7H14O3 146.094295
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