Structure Database (LMSD)

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LMSD: Lipid classification search results

Branched fatty acids [FA0102]

LM_ID Common Name Systematic Name Species Shorthand Formula Mass
LMFA08020180 Herculin (2E,8E)-N-(2-methylpropyl)dodeca-2,8-dienamide NA 16:2 C16H29NO 251.224914
LMFA08020181 Hydroxy-epsilon-sanshool (2E,6Z,8E,10Z)-N-(2-hydroxy-2-methylpropyl)dodeca-2,6,8,10-tetraenamide NA 16:4;O C16H25NO2 263.188529
LMFA08020185 manumycin (2E,4E,6R)-N-[(1S,5S,6R)-5-hydroxy-5-[(1E,3E,5E)-7-[(2-hydroxy-5-oxo-cyclopenten-1-yl)amino]-7-oxo-hepta-1,3,5-trienyl]-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]-2,4,6-trimethyl-deca-2,4-dienamide C31H38N2O7 550.267903
LMFA08020186 N-(2-Hydroxyisobutyl)-2,4,8,10,12-tetradecapentaenamide (2E,4E,8E,10E,12E)-N-(2-hydroxy-2-methylpropyl)tetradeca-2,4,8,10,12-pentaenamide NA 18:5;O C18H27NO2 289.204179
LMFA08020189 N,2,3-Trimethyl-2-(1-methylethyl)butanamide N,2,3-trimethyl-2-(propan-2-yl)butanamide NA 10:0 C10H21NO 171.162314
LMFA08020192 Neopellitorine A (2E,4E)-N-(2-methylpropyl)undeca-2,4-dien-7,9-diynamide NA 15:6 C15H19NO 229.146664
LMFA08020195 N-Isobutyl-2,4,8,10,12-tetradecapentaenamide (2E,4E,8E,10E,12E)-N-(2-methylpropyl)tetradeca-2,4,8,10,12-pentaenamide NA 18:5 C18H27NO 273.209264
LMFA08020198 Pantothenol (2R)-2,4-dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide NA 9:0;O3 C9H19NO4 205.131409
LMFA08020200 Pipericine (2E,4E)-N-(2-methylpropyl)octadeca-2,4-dienamide NA 22:2 C22H41NO 335.318814
LMFA08020204 TMC-1A (2E)-N-[(3S,4R)-3,4-dihydroxy-3-{(1E,3E,5E)-7-[(2-hydroxy-5-oxocyclopent-1-en-1-yl)amino]-7-oxohepta-1,3,5-trien-1-yl}-6-oxocyclohex-1-en-1-yl]-2,4-dimethyloct-2-enamide C28H36N2O7 512.252253
LMFA08020205 TMC-1C (2E,4E)-N-[(3S,4R)-3,4-dihydroxy-3-[(1E,3E,5E)-7-[(2-hydroxy-5-oxocyclopent-1-en-1-yl)amino]-7-oxohepta-1,3,5-trienyl]-6-oxocyclohex-1-en-1-yl]-4,6-dimethyldeca-2,4-dienamide C30H38N2O7 538.267903
LMFA08020206 TMC-1D (2E)-N-[(3S,4R)-3,4-dihydroxy-3-[(1E,3E,5E)-7-[(2-hydroxy-5-oxocyclopenten-1-yl)amino]-7-oxohepta-1,3,5-trienyl]-6-oxocyclohexen-1-yl]-4,6-dimethyldec-2-enamide C30H40N2O7 540.283553
LMFA08010022 S-(2-Methylpropionyl)-dihydrolipoamide-E 8-[(2-methylpropanoyl)sulfanyl]-6-sulfanyloctanamide C12H23NO2S2 277.117023
LMFA08010024 Sakacin P tert-butyl N-(1-carbamoyl-1-oxopropan-2-yl)carbamate C9H16N2O4 216.111008
LMFA07070029 2,6 dimethylheptanoyl carnitine 3-[(2,6-dimethylheptanoyl)oxy]-4-(trimethylazaniumyl)butanoate CAR 9:0 C16H31NO4 301.225309
LMFA07070030 2-ethylacryloylcarnitine 3-[(2-methylidenebutanoyl)oxy]-4-(trimethylammonio)butanoate CAR 5:1 C12H21NO4 243.147059
LMFA07070034 2-Methylbutyroylcarnitine 3-[(2-methylbutanoyl)oxy]-4-(trimethylazaniumyl)butanoate CAR 5:0 C12H23NO4 245.162709
LMFA07070041 3-hydroxyisovalerylcarnitine 3-[(3-hydroxy-3-methylbutanoyl)oxy]-4-(trimethylazaniumyl)butanoate CAR 5:0;O C12H23NO5 261.157624
LMFA07070046 4,8 dimethylnonanoyl carnitine 3-[(4,8-dimethylnonanoyl)oxy]-4-(trimethylazaniumyl)butanoate CAR 11:0 C18H35NO4 329.256609
LMFA07070073 hydroxyisovaleroyl carnitine 3-hydroxy-3-isovaleryloxy-4-(trimethylammonio)butyrate CAR 5:0;O C12H23NO5 261.157624
LMFA07070075 Isobutyryl-L-carnitine 3-[(2-methylpropanoyl)oxy]-4-(trimethylazaniumyl)butanoate CAR 4:0 C11H21NO4 231.147059
LMFA07070076 Isovalerylcarnitine 3-[(3-methylbutanoyl)oxy]-4-(trimethylazaniumyl)butanoate CAR 5:0 C12H23NO4 245.162709
LMFA07070077 isovaleryl-L-carnitine (3R)-3-[(3-methylbutanoyl)oxy]-4-(trimethylazaniumyl)butanoate CAR 5:0 C12H23NO4 245.162709
LMFA07070081 Methylmalonylcarnitine (3S)-3-[(2-carboxy-2-methylacetyl)oxy]-4-(trimethylazaniumyl)butanoate CAR 4:1;O2 C11H19NO6 261.121239
LMFA07070094 O-methylmalonylcarnitine 3-[(2-carboxypropanoyl)oxy]-4-(trimethylazaniumyl)butanoate CAR 4:1;O2 C11H19NO6 261.121239
LMFA07070103 pivaloylcarnitine 3-[(2,2-dimethylpropanoyl)oxy]-4-(trimethylazaniumyl)butanoate CAR 5:0 C12H23NO4 245.162709
LMFA07070108 Tiglylcarnitine 3-{[(2E)-2-methylbut-2-enoyl]oxy}-4-(trimethylazaniumyl)butanoate CAR 5:1 C12H21NO4 243.147059
LMFA07050092 (11Z)-3-oxoicosa-11-enoyl-CoA 3-oxo-11Z-eicosenoyl-CoA CoA 20:2;O C41H70N7O18P3S 1073.371099
LMFA07050093 (11Z)-eicosenoyl-CoA 11Z-eicosenoyl-CoA CoA 20:1 C41H72N7O17P3S 1059.391834
LMFA07050094 (11Z,14Z)-3-oxoicosa-11,14-dienoyl-CoA 3-oxo-11Z,14Z-eicosadienoyl-CoA CoA 20:3;O C41H68N7O18P3S 1071.355449
LMFA07050095 (11Z,14Z,17Z)-3-oxoicosatrienoyl-CoA 3-oxo-11Z,14Z,17Z-eicosatrienoyl-CoA CoA 20:4;O C41H66N7O18P3S 1069.339799
LMFA07050096 (13Z)-3-oxodocosenoyl-CoA 3-oxo-13Z-docosenoyl-CoA CoA 22:2;O C43H74N7O18P3S 1101.402399
LMFA07050097 (15Z)-3-oxotetracosenoyl-CoA 3-oxo-15Z-tetracosenoyl-CoA CoA 24:2;O C45H78N7O18P3S 1129.433699
LMFA07050098 (15Z)-tetracosenoyl-CoA 15Z-tetracosenoyl-CoA CoA 24:1 C45H80N7O17P3S 1115.454434
LMFA07050099 (17Z)-hexacosenoyl-CoA 17Z-hexacosenoyl-CoA CoA 26:1 C47H84N7O17P3S 1143.485734
LMFA07050100 (1-hydroxycyclohexyl)acetyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(1-hydroxycyclohexyl)acetyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} CoA 8:1;O C29H48N7O18P3S 907.198949
LMFA07050107 (2E,6Z,9Z,12Z,15Z,18Z,21Z)-tetracosaheptaenoyl-CoA 2E,6Z,9Z,12Z,15Z,18Z,21Z-tetracosaheptaenoyl-CoA CoA 24:7 C45H68N7O17P3S 1103.360534
LMFA07050108 (2S)-ethylmalonyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2S)-2-carboxybutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} CoA 5:1;O2 C26H42N7O19P3S 881.146914
LMFA07050109 (2S,3S)-3-hydroxy-2-methylbutanoyl-CoA 3S-hydroxy-2S-methylbutanoyl-CoA CoA 5:0;O C26H44N7O18P3S 867.167649
LMFA07050110 (2-trans,4-cis)-deca-2,4-dienoyl-CoA 2E,4Z-decadienoyl-CoA CoA 10:2 C31H50N7O17P3S 917.219684
LMFA07050111 (2-trans,6-cis)-dodeca-2,6-dienoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E,6Z)-dodeca-2,6-dienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} CoA 12:2 C33H54N7O17P3S 945.250984
LMFA07050112 (2Z)-4-carboxy-2-sulfanylbut-2-enoyl-CoA 5'-O-[({[4-({3-[(2-{[(2Z)-4-carboxy-2-sulfanylbut-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]adenosine 3'-(dihydrogen phosphate) C26H40N7O19P3S2 911.103336
LMFA07050113 (3E,5Z)-tetradecadienoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-{[(3E,5Z)-tetradeca-3,5-dienoyl]sulfanyl}ethyl)amino]propyl}amino)butyl] dihydrogen diphosphate} CoA 14:2 C35H58N7O17P3S 973.282284
LMFA07050114 (3R)-3-isopropenyl-6-oxoheptanoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-{[(3R)-6-oxo-3-(prop-1-en-2-yl)heptanoyl]sulfanyl}ethyl)amino]propyl}amino)butyl] dihydrogen diphosphate} CoA 10:2;O C31H50N7O18P3S 933.214599
LMFA07050116 (3S)-3-hydroxy-3-methylglutaryl-CoA 3S-hydroxy-3-methyl-5-carboxypentanoyl-CoA CoA 6:1;O3 C27H44N7O20P3S 911.157479
LMFA07050117 (3S)-3-Hydroxyadipyl-CoA (4R)-6-{[2-(3-{3-[({[({[(2S,3R,4S,5S)-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}-4-hydroxy-6-oxohexanoic acid CoA 6:1;O3 C27H44N7O20P3S 911.157479
LMFA07050118 (3S)-3-isopropenyl-6-oxoheptanoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-{[(3S)-6-oxo-3-(prop-1-en-2-yl)heptanoyl]sulfanyl}ethyl)amino]propyl}amino)butyl] dihydrogen diphosphate} CoA 10:2;O C31H50N7O18P3S 933.214599
LMFA07050119 (3S)-citramalyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(3S)-3-carboxy-3-hydroxybutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} CoA 5:1;O3 C26H42N7O20P3S 897.141829
LMFA07050120 (3S)-citryl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(3S)-3,4-dicarboxy-3-hydroxybutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} CoA 6:2;O5 C27H42N7O22P3S 941.131659
LMFA07050121 (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-CoA 4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl-CoA CoA 22:6 C43H66N7O17P3S 1077.344884