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
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
LMFA07050398 Undecanoyl-CoA Undecanoyl-CoA CoA 11:0 C32H56N7O17P3S 935.266634
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
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 835.141434
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
LMFA07010888 Eunicea sesquiterpenoid 7 (1S,2E,10R)-10-acetyl-3-methyl-7-methylidene-6-oxocyclodec-2-en-1-yl (2E)-4-hydroxy-4-methylpent-2-enoate WE 20:6;O3 C20H28O5 348.193675
LMFA07070112 Gamma-linolenyl carnitine (4S)-4-[(6Z,9Z,12Z)-octadeca-6,9,12-trienoyloxy]-4-(trimethylazaniumyl)butanoate CAR 18:3 C25H43NO4 421.319209
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 346.235540
LMFA07011018 Sorbitan oleate 2-(3,4-dihydroxyoxolan-2-yl)-2-hydroxyethyl (9E)-octadec-9-enoate WE 24:2;O4 C24H44O6 428.313790
LMFA07011019 Sorbitan palmitate 2-(3,4-dihydroxyoxolan-2-yl)-2-hydroxyethyl hexadecanoate WE 22:1;O4 C22H42O6 402.298140
LMFA07011020 Sorbitan stearate 2-(3,4-dihydroxyoxolan-2-yl)-2-hydroxyethyl octadecanoate WE 24:1;O4 C24H46O6 430.329440
LMFA01060215 (7E,9E,15E)-heptadeca-7,9,15-trien-11,13-diyn-4-one Heptadeca-7E,9E,15E-trien-11,13-diyn-4-one FA 17:7;O C17H20O 240.151415
LMFA03060112 8,15-diHETE(n-3) 8,15-dihydroxy-9Z,11E,13E,17Z-eicosatetraenoic acid FA 20:4;O2 C20H32O4 336.230060
LMFA01120011 12-cys-9-nitro-octadecenoic acid 12-cysteinyl-9-nitro-9Z-octadecenoic acid C21H38N2O6S 446.245060
LMFA01120012 10-cys-9-nitro-octadecenoic acid 10-cysteinyl-9-nitro-11E-octadecenoic acid C21H38N2O6S 446.245060
LMFA01120013 9-Cys-12-nitro-octadecenoic acid 9-cysteinyl-12-nitro-11E-octadecenoic acid C21H38N2O6S 446.245060
LMFA01120014 11-cys-12-nitro-octadecenoic acid 11-cysteinyl-12-nitro-9E-octadecenoic acid C21H38N2O6S 446.245060
LMFA01031152 Methyl-(5Z,7E,9E,14Z,17Z)-eicosapentaenoate Methyl-(5Z,7E,9E,14Z,17Z)-eicosa-5,7,9,14,17-pentaenoate FA 21:5 C21H32O2 316.240230
LMFA01031153 Methyl-(5E,7E,9E,14Z,17Z) eicosapentaenoate Methyl-(5E,7E,9E,14Z,17Z)-eicosa-5,7,9,14,17-pentaenoate FA 21:5 C21H32O2 316.240230
LMFA01031154 Methyl-(5Z,8Z,11Z,14Z,17Z)-eicosapentaenoate Methyl-(5Z,8Z,11Z,14Z,17Z)-eicosa-(5,8,11,14,17)-pentaenoate FA 21:5 C21H32O2 316.240230
LMFA03000017 Ethyl-(5S,12S)-diacetoxy-(6E,8E,10E,14Z)-eicosatetraenoate Ethyl-(5S,12S)-diacetoxy-(6E,8E,10E,14Z)-eicosa-(6,8,10,14)-tetraenoate FA 26:6;O4 C26H40O6 448.282490
LMFA03000016 Ethyl-(5R,12S)-diacetoxy-(6E,8E,10E,14Z)-eicosatetraenoate Ethyl-(5R,12S)-diacetoxy-(6E,8E,10E,14Z)-eicosa-(6,8,10,14)-tetraenoate FA 26:6;O4 C26H40O6 448.282490
LMFA01060220 11-oxo-undeca-5,8-dienoic acid 11-oxo-undeca-(5Z,8Z)-dienoic acid FA 11:3;O C11H16O3 196.109945
LMFA01060221 11-oxo-undeca-5,9-dienoic acid 11-oxo-undeca-(5Z,9E)-dienoic acid FA 11:3;O C11H16O3 196.109945
LMFA01060222 12-oxo-dodeca-5,8,10-trienoic acid 12-oxo-dodeca-(5Z,8Z,10E)-trienoic acid FA 12:4;O C12H16O3 208.109945
LMFA02000329 13R-HPODE 13R-hydroperoxy-9Z,11E-octadecadienoic acid FA 18:2;O2 C18H32O4 312.230060
LMFA08020220 N-oleyl-Ala-His N-oleyl-beta-alanine-L-histidine C27H46N4O4 490.351906
LMFA08020209 Oxidized macamide N-(9-oxo-10Z,12Z-octadecadienoyl)-benzylamine NA 25:7;O C25H37NO2 383.282429
LMFA01100064 Myristamide tetradecamide C14H29NO 227.224914
LMFA08020228 alpha-N-(3-(11,12-methylene)-octadecanoyloxy-octadecanoyl)-L-ornithine (2S)-5-amino-2-(3-(11,12-methylene)-octadecanoyloxy-octadecanamido)pentanoic acid C42H80N2O5 692.606723
LMFA07050401 9E-Dodecenoyl-CoA 9E-Dodecenoyl-CoA CoA 12:1 C33H56N7O17P3S 947.266634
LMFA07050402 8E,10-Dodecadienoyl-CoA 8E,10-Dodecadienoyl-CoA CoA 12:2 C33H54N7O17P3S 945.250984
LMFA08020355 TMC-1B (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]-2,6-dimethyloct-2-enamide C28H36N2O7 512.252253
LMFA02020213 (1R,2R,2'E)-2-(5'-ethoxy-5'-oxo-2-penten-1-yl)-3-oxo-cyclopentane acetic acid methyl ester FA 15:4;O3 C15H22O5 282.146725
LMFA02020218 Methyl 12-hydroxyjasmonate methyl (1R,2R,2'Z)-2-(5'- hydroxy-2'-enyl)-3-oxo-cyclopentane-acetate FA 13:3;O2 C13H20O4 240.136160