Structure Database (LMSD)

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LMSD: Lipid classification search results

Fatty Acids and Conjugates [FA01]

LM_ID Common Name Systematic Name Species Shorthand Formula Mass
LMFA07050315 Dephospho-CoA [({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy][3-hydroxy-2,2-dimethyl-3-({2-[(2-sulfanylethyl)carbamoyl]ethyl}carbamoyl)propoxy]phosphinic acid C21H35N7O13P2S 687.148878
LMFA07050315 Dephospho-CoA [({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy][3-hydroxy-2,2-dimethyl-3-({2-[(2-sulfanylethyl)carbamoyl]ethyl}carbamoyl)propoxy]phosphinic acid C21H35N7O13P2S 687.148878
LMFA07050315 Dephospho-CoA [({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy][3-hydroxy-2,2-dimethyl-3-({2-[(2-sulfanylethyl)carbamoyl]ethyl}carbamoyl)propoxy]phosphinic acid C21H35N7O13P2S 687.148878
LMFA01040058 methyl 9,12,13,15-bisepidioxy-16-hydroperoxy-10-octadecenoate methyl 9,12,13,15-bisepidioxy-16-hydroperoxy-10-octadecenoate FA 19:3;O6 C19H32O8 388.209721
LMFA01040058 methyl 9,12,13,15-bisepidioxy-16-hydroperoxy-10-octadecenoate methyl 9,12,13,15-bisepidioxy-16-hydroperoxy-10-octadecenoate FA 19:3;O6 C19H32O8 388.209721
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
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
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
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
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
LMFA07020002 2-(9R-(15Z-docosenoyloxy)-3-methyl-2Z-decenoyloxy)-ethanesulfonic acid 2-(9R-(15Z-docosenoyloxy)-3-methyl-2Z-decenoyloxy)-ethanesulfonic acid C35H64O7S 628.437277
LMFA07020002 2-(9R-(15Z-docosenoyloxy)-3-methyl-2Z-decenoyloxy)-ethanesulfonic acid 2-(9R-(15Z-docosenoyloxy)-3-methyl-2Z-decenoyloxy)-ethanesulfonic acid C35H64O7S 628.437277
LMFA07050263 4-carboxy-2-thioxobutanoyl-CoA 5'-O-[{[(4-{[3-({2-[(4-carboxy-2-thioxobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutoxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]adenosine 3'-(dihydrogen phosphate) C26H40N7O19P3S2 911.103325
LMFA07050263 4-carboxy-2-thioxobutanoyl-CoA 5'-O-[{[(4-{[3-({2-[(4-carboxy-2-thioxobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutoxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]adenosine 3'-(dihydrogen phosphate) C26H40N7O19P3S2 911.103325
LMFA07050263 4-carboxy-2-thioxobutanoyl-CoA 5'-O-[{[(4-{[3-({2-[(4-carboxy-2-thioxobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutoxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]adenosine 3'-(dihydrogen phosphate) C26H40N7O19P3S2 911.103325
LMFA07050263 4-carboxy-2-thioxobutanoyl-CoA 5'-O-[{[(4-{[3-({2-[(4-carboxy-2-thioxobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutoxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]adenosine 3'-(dihydrogen phosphate) C26H40N7O19P3S2 911.103325
LMFA07050263 4-carboxy-2-thioxobutanoyl-CoA 5'-O-[{[(4-{[3-({2-[(4-carboxy-2-thioxobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutoxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]adenosine 3'-(dihydrogen phosphate) C26H40N7O19P3S2 911.103325
LMFA07050263 4-carboxy-2-thioxobutanoyl-CoA 5'-O-[{[(4-{[3-({2-[(4-carboxy-2-thioxobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutoxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]adenosine 3'-(dihydrogen phosphate) C26H40N7O19P3S2 911.103325
LMFA07050278 8Z,11Z,14Z,17Z-tricosatetraenoyl-CoA {[(2R,3R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-2,2-dimethyl-3-{[2-({2-[(8Z,11Z,14Z,17Z)-tricosa-8,11,14,17-tetraenoylsulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}propoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid CoA 23:4 C44H72N7O17P3S 1095.391825
LMFA07050278 8Z,11Z,14Z,17Z-tricosatetraenoyl-CoA {[(2R,3R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-2,2-dimethyl-3-{[2-({2-[(8Z,11Z,14Z,17Z)-tricosa-8,11,14,17-tetraenoylsulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}propoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid CoA 23:4 C44H72N7O17P3S 1095.391825
LMFA07050278 8Z,11Z,14Z,17Z-tricosatetraenoyl-CoA {[(2R,3R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-2,2-dimethyl-3-{[2-({2-[(8Z,11Z,14Z,17Z)-tricosa-8,11,14,17-tetraenoylsulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}propoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid CoA 23:4 C44H72N7O17P3S 1095.391825
LMFA07050278 8Z,11Z,14Z,17Z-tricosatetraenoyl-CoA {[(2R,3R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-2,2-dimethyl-3-{[2-({2-[(8Z,11Z,14Z,17Z)-tricosa-8,11,14,17-tetraenoylsulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}propoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid CoA 23:4 C44H72N7O17P3S 1095.391825
LMFA07050278 8Z,11Z,14Z,17Z-tricosatetraenoyl-CoA {[(2R,3R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-2,2-dimethyl-3-{[2-({2-[(8Z,11Z,14Z,17Z)-tricosa-8,11,14,17-tetraenoylsulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}propoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid CoA 23:4 C44H72N7O17P3S 1095.391825
LMFA07050013 3-oxo-dodecanoyl-CoA 3-oxo-dodecanoyl-CoA CoA 12:1;O C33H56N7O18P3S 963.261539
LMFA07050013 3-oxo-dodecanoyl-CoA 3-oxo-dodecanoyl-CoA CoA 12:1;O C33H56N7O18P3S 963.261539
LMFA07050013 3-oxo-dodecanoyl-CoA 3-oxo-dodecanoyl-CoA CoA 12:1;O C33H56N7O18P3S 963.261539
LMFA07050013 3-oxo-dodecanoyl-CoA 3-oxo-dodecanoyl-CoA CoA 12:1;O C33H56N7O18P3S 963.261539
LMFA07050013 3-oxo-dodecanoyl-CoA 3-oxo-dodecanoyl-CoA CoA 12:1;O C33H56N7O18P3S 963.261539
LMFA07050013 3-oxo-dodecanoyl-CoA 3-oxo-dodecanoyl-CoA CoA 12:1;O C33H56N7O18P3S 963.261539
LMFA07050064 2S-Pristanoyl-CoA 2S,6R,10R,14-tetramethylpentadecanoyl-CoA CoA 19:0 C40H72N7O17P3S 1047.391825
LMFA07050064 2S-Pristanoyl-CoA 2S,6R,10R,14-tetramethylpentadecanoyl-CoA CoA 19:0 C40H72N7O17P3S 1047.391825
LMFA07050064 2S-Pristanoyl-CoA 2S,6R,10R,14-tetramethylpentadecanoyl-CoA CoA 19:0 C40H72N7O17P3S 1047.391825
LMFA07050064 2S-Pristanoyl-CoA 2S,6R,10R,14-tetramethylpentadecanoyl-CoA CoA 19:0 C40H72N7O17P3S 1047.391825
LMFA07050064 2S-Pristanoyl-CoA 2S,6R,10R,14-tetramethylpentadecanoyl-CoA CoA 19:0 C40H72N7O17P3S 1047.391825
LMFA07020004 2-(9R-(tricosanoyloxy)-3-methyl-2Z-decenoyloxy)-ethanesulfonic acid 2-(9R-(tricosanoyloxy)-3-methyl-2Z-decenoyloxy)-ethanesulfonic acid C36H68O7S 644.468577
LMFA07020004 2-(9R-(tricosanoyloxy)-3-methyl-2Z-decenoyloxy)-ethanesulfonic acid 2-(9R-(tricosanoyloxy)-3-methyl-2Z-decenoyloxy)-ethanesulfonic acid C36H68O7S 644.468577
LMFA01090163 2-chloro-stearic acid 2-chlorooctadecanoic acid C18H35O2Cl 318.232559
LMFA01030451 3,5-hexadienoic acid 3,5-hexadienoic acid FA 6:2 C6H8O2 112.052430
LMFA03070017 methyl 11-hydroperoxy-5,8,12,14,17-eicosapentaenoate methyl 11-hydroperoxy-5,8,12,14,17-eicosapentaenoate FA 21:5;O2 C21H32O4 348.230061
LMFA01160001 alpha,alpha'-Trehalose 6-mycolate 6-O-[3-hydroxy-2-tetradecyloctadec-11E-enoyl]-alpha-D-glucopyranosyl alpha-D-glucopyranoside FA 44:3;O11 C44H82O13 818.575547
LMFA01160001 alpha,alpha'-Trehalose 6-mycolate 6-O-[3-hydroxy-2-tetradecyloctadec-11E-enoyl]-alpha-D-glucopyranosyl alpha-D-glucopyranoside FA 44:3;O11 C44H82O13 818.575547
LMFA01160001 alpha,alpha'-Trehalose 6-mycolate 6-O-[3-hydroxy-2-tetradecyloctadec-11E-enoyl]-alpha-D-glucopyranosyl alpha-D-glucopyranoside FA 44:3;O11 C44H82O13 818.575547
LMFA01040057 methyl 10,12,13,16-bisepidioxy-9-hydroperoxy-14-octadecenoate methyl 10,12,13,16-bisepidioxy-9-hydroperoxy-14-octadecenoate FA 19:3;O6 C19H32O8 388.209721
LMFA01040057 methyl 10,12,13,16-bisepidioxy-9-hydroperoxy-14-octadecenoate methyl 10,12,13,16-bisepidioxy-9-hydroperoxy-14-octadecenoate FA 19:3;O6 C19H32O8 388.209721
LMFA01040049 methyl 10,16-dihydroperoxy-8E,12Z,14E-octadecatrienoate methyl 10,16-dihydroperoxy-8E,12Z,14E-octadecatrienoate FA 19:3;O4 C19H32O6 356.219891
LMFA01040049 methyl 10,16-dihydroperoxy-8E,12Z,14E-octadecatrienoate methyl 10,16-dihydroperoxy-8E,12Z,14E-octadecatrienoate FA 19:3;O4 C19H32O6 356.219891
LMFA08020178 FR901465 (2S,3Z)-5-{[(2R,3R,5S,6S)-2,5-dimethyl-6-{(2E,4E)-3-methyl-5-[(3R,4R,5R,7S,8R)-4,7,8-trihydroxy-7-methyl-1,6-dioxaspiro[2.5]oct-5-yl]penta-2,4-dien-1-yl}tetrahydro-2H-pyran-3-yl]amino}-5-oxopent-3-en-2-yl acetate NA 27:7;O8 C27H41NO9 523.278134
LMFA08020178 FR901465 (2S,3Z)-5-{[(2R,3R,5S,6S)-2,5-dimethyl-6-{(2E,4E)-3-methyl-5-[(3R,4R,5R,7S,8R)-4,7,8-trihydroxy-7-methyl-1,6-dioxaspiro[2.5]oct-5-yl]penta-2,4-dien-1-yl}tetrahydro-2H-pyran-3-yl]amino}-5-oxopent-3-en-2-yl acetate NA 27:7;O8 C27H41NO9 523.278134
LMFA08020178 FR901465 (2S,3Z)-5-{[(2R,3R,5S,6S)-2,5-dimethyl-6-{(2E,4E)-3-methyl-5-[(3R,4R,5R,7S,8R)-4,7,8-trihydroxy-7-methyl-1,6-dioxaspiro[2.5]oct-5-yl]penta-2,4-dien-1-yl}tetrahydro-2H-pyran-3-yl]amino}-5-oxopent-3-en-2-yl acetate NA 27:7;O8 C27H41NO9 523.278134
LMFA08020178 FR901465 (2S,3Z)-5-{[(2R,3R,5S,6S)-2,5-dimethyl-6-{(2E,4E)-3-methyl-5-[(3R,4R,5R,7S,8R)-4,7,8-trihydroxy-7-methyl-1,6-dioxaspiro[2.5]oct-5-yl]penta-2,4-dien-1-yl}tetrahydro-2H-pyran-3-yl]amino}-5-oxopent-3-en-2-yl acetate NA 27:7;O8 C27H41NO9 523.278134