Structure Database (LMSD)

LM_ID Common Name Systematic Name Main class Sub class Mass Formula
LMST04020041 Dihomoavicholic acid 24-dihomo-3alpha,7alpha,16alpha-trihydroxy-5beta-cholan-26-oic acid Bile acids and derivatives [ST04] C26 bile acids, alcohols, and derivatives [ST0402] 436.32 C26H44O5
LMST04020032 Dihomochenodeoxycholic acid 24-dihomo-3alpha,7alpha-dihydroxy-5beta-cholan-26-oic acid Bile acids and derivatives [ST04] C26 bile acids, alcohols, and derivatives [ST0402] 420.32 C26H44O4
LMST04020030 Dihomocholic acid 24-dihomo-3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-26-oic acid Bile acids and derivatives [ST04] C26 bile acids, alcohols, and derivatives [ST0402] 436.32 C26H44O5
LMST04020031 Dihomodeoxycholic acid 24-dihomo-3alpha,12alpha-dihydroxy-5beta-cholan-26-oic acid Bile acids and derivatives [ST04] C26 bile acids, alcohols, and derivatives [ST0402] 420.32 C26H44O4
LMST04020034 Dihomohyocholic acid 24-dihomo-3alpha,6alpha,7alpha-trihydroxy-5beta-cholan-26-oic acid Bile acids and derivatives [ST04] C26 bile acids, alcohols, and derivatives [ST0402] 436.32 C26H44O5
LMST04020036 Dihomohyodeoxycholic acid 24-dihomo-3alpha,6alpha-dihydroxy-5beta-cholan-26-oic acid Bile acids and derivatives [ST04] C26 bile acids, alcohols, and derivatives [ST0402] 420.32 C26H44O4
LMST04020035 Dihomolithocholic acid 24-dihomo-3alpha-hydroxy-5beta-cholan-26-oic acid Bile acids and derivatives [ST04] C26 bile acids, alcohols, and derivatives [ST0402] 404.33 C26H44O3
LMST04020040 Dihomomurideoxycholic acid 24-dihomo-3alpha,6beta-dihydroxy-5beta-cholan-26-oic acid Bile acids and derivatives [ST04] C26 bile acids, alcohols, and derivatives [ST0402] 420.32 C26H44O4
LMST04020033 Dihomoursodeoxycholic acid 24-dihomo-3alpha,7beta-dihydroxy-5beta-cholan-26-oic acid Bile acids and derivatives [ST04] C26 bile acids, alcohols, and derivatives [ST0402] 420.32 C26H44O4
LMST04020001 3Alpha,7Alpha,12Alpha-trihydroxy-27-nor-5Beta-cholestan-24-one Bile acids and derivatives [ST04] C26 bile acids, alcohols, and derivatives [ST0402] 420.32 C26H44O4
LMST04020042 3beta-hydroxy-26-norcampest-5-en-25-oic acid Bile acids and derivatives [ST04] C26 bile acids, alcohols, and derivatives [ST0402] 402.31 C26H42O3
LMST04030254 7alpha-Hydroxy-3,24-bisoxocholest-4-en-(25R)26-oyl-CoA Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 1193.39 C48H74N7O20P3S
LMST04030256 7alpha,24R-Dihydroxy-3-oxocholest-4-en-(25R)26-oyl-CoA Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 1195.41 C48H76N7O20P3S
LMST04030257 7alpha,24R-Dihydroxy-3-oxocholest-4-en-(25R)26-oic acid Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 446.3 C27H42O5
LMST04030176 (20R)-17alpha,20-dihydroxycholesterol (20R)-cholest-5-en-3beta,17alpha,20-triol Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 418.34 C27H46O3
LMST04030229 (24E)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholest-24-en-26-oyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-{[(24E)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholest-24-en-26-oyl]sulfanyl}ethyl)amino]propyl}amino)butyl] dihydrogen diphosphate} Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 1197.42 C48H78N7O20P3S
LMST04030175 (24R)-7alpha,24-dihydroxycholesterol (24R)-cholest-5-en-3beta,7alpha,24-triol Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 418.34 C27H46O3
LMST04030230 (24R,25R)-3alpha,7alpha,12alpha,24-tetrahydroxy-5beta-cholestan-26-oyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-{[(24R,25R)-3alpha,7alpha,12alpha,24-tetrahydroxy-5beta-cholestan-26-oyl]sulfanyl}ethyl)amino]propyl}amino)butyl] dihydrogen diphosphate} Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 1215.43 C48H80N7O21P3S
LMST04030189 (25R)-1beta,3alpha,7alpha,12alpha-tetrahydroxy-5beta-cholestan-26-oic acid (25R)-1beta,3alpha,7alpha,12alpha-tetrahydroxy-5beta-cholestan-26-oic acid Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 466.33 C27H46O6
LMST04030188 (25R)-1beta,3alpha,7alpha-trihydroxy-5beta-cholestan-26-oic acid (25R)-1beta,3alpha,7alpha-trihydroxy-5beta-cholestan-26-oic acid Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 450.33 C27H46O5
LMST04030195 (25R)-3alpha,7alpha,12alpha,24R-tetrahydroxy-5beta-cholestan-26-oic acid (25R)-3alpha,7alpha,12alpha,24R-tetrahydroxy-5beta-cholestan-26-oic acid Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 466.33 C27H46O6
LMST04030197 (25R)-3alpha,7alpha,12alpha,24S-tetrahydroxy-5beta-cholestan-26-oic acid (25R)-3alpha,7alpha,12alpha,24S-tetrahydroxy-5beta-cholestan-26-oic acid Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 466.33 C27H46O6
LMST04030181 (25R)-3alpha,7alpha,12alpha-trihydroxy-5alpha-cholestan-26-oic acid (25R)-3alpha,7alpha,12alpha-trihydroxy-5alpha-cholestan-26-oic acid Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 450.33 C27H46O5
LMST04030161 (25R)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-al (25R)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-al Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 434.34 C27H46O4
LMST04030151 (25R)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oic acid (25R)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oic acid Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 450.33 C27H46O5
LMST04030231 (25R)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-{[(25R)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oyl]sulfanyl}ethyl)amino]propyl}amino)butyl] dihydrogen diphosphate} Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 1199.44 C48H80N7O20P3S
LMST04030183 (25R)-3alpha,7alpha,24-trihydroxy-5alpha-cholestan-26-oic acid (25R)-3alpha,7alpha,24-trihydroxy-5alpha-cholestan-26-oic acid Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 450.33 C27H46O5
LMST04030153 (25R)-3alpha,7alpha-dihydroxy-5beta-cholestan-26-oic acid (25R)-3alpha,7alpha-dihydroxy-5beta-cholestan-26-oic acid Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 434.34 C27H46O4
LMST04030232 (25R)-3alpha,7alpha-dihydroxy-5beta-cholestan-26-oyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(25R)-3alpha,7alpha-dihydroxy-5beta-cholestan-26-oyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 1183.44 C48H80N7O19P3S
LMST04030160 (25R)-5beta-cholestane-3alpha,7alpha,12alpha,26-tetrol (25R)-5beta-cholestane-3alpha,7alpha,12alpha,26-tetrol Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 436.36 C27H48O4
LMST04030252 (25R)-7alpha-hydroxy-3-oxo-4-cholestenoyl CoA 7alpha-hydroxy-3-oxocholest-4-en-(25R)26-oyl CoA Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 1179.41 C48H76N7O19P3S
LMST04030217 (25R)-Delta(4)-dafachronic acid (25R)-3-oxocholest-4-en-26-oic acid Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 414.31 C27H42O3
LMST04030218 (25R)-Delta(7)-dafachronic acid (5alpha,25R)-3-oxocholest-7-en-26-oic acid Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 414.31 C27H42O3
LMST04030190 (25S)-2beta,3alpha,7alpha,12alpha-tetrahydroxy-5beta-cholestan-26-oic acid (25S)-2beta,3alpha,7alpha,12alpha-tetrahydroxy-5beta-cholestan-26-oic acid Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 466.33 C27H46O6
LMST04030194 (25S)-3alpha,7alpha,12alpha,24R-tetrahydroxy-5beta-cholestan-26-oic acid (25S)-3alpha,7alpha,12alpha,24R-tetrahydroxy-5beta-cholestan-26-oic acid Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 466.33 C27H46O6
LMST04030196 (25S)-3alpha,7alpha,12alpha,24S-tetrahydroxy-5beta-cholestan-26-oic acid (25S)-3alpha,7alpha,12alpha,24S-tetrahydroxy-5beta-cholestan-26-oic acid Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 466.33 C27H46O6
LMST04030182 (25S)-3alpha,7alpha,12alpha-trihydroxy-5alpha-cholestan-26-oic acid (25S)-3alpha,7alpha,12alpha-trihydroxy-5alpha-cholestan-26-oic acid Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 450.33 C27H46O5
LMST04030152 (25S)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oic acid (25S)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oic acid Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 450.33 C27H46O5
LMST04030233 (25S)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestanoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-{[(25S)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oyl]sulfanyl}ethyl)amino]propyl}amino)butyl] dihydrogen diphosphate} Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 1199.44 C48H80N7O20P3S
LMST04030159 (25S)-5beta-cholestane-3alpha,7alpha,12alpha,26-tetrol (25S)-5beta-cholestane-3alpha,7alpha,12alpha,26-tetrol Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 436.36 C27H48O4
LMST04030253 (25S)-7alpha-hydroxy-3-oxo-4-cholestenoyl CoA 7alpha-hydroxy-3-oxocholest-4-en-(25S)26-oyl CoA Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 1179.41 C48H76N7O19P3S
LMST04030221 (25S)-Delta(4)-dafachronic acid (25S)-3-oxocholest-4-en-26-oic acid Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 414.31 C27H42O3
LMST04030222 (25S)-Delta(7)-dafachronic acid (25S)-3-oxocholest-7-en-26-oic acid Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 414.31 C27H42O3
LMST04030219 (25S)-cholestenoic acid (25S)-3beta-hydroxycholest-5-en-26-oic acid Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 416.33 C27H44O3
LMST04030220 (25S)-dafachronic acid (5alpha,25S)-3-oxocholestan-26-oic acid Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 416.33 C27H44O3
LMST04030223 (25S)-delta(1,7)-dafachronic acid (5alpha,25S)-3-oxocholest-1,7-dien-26-oic acid Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 412.3 C27H40O3
LMST04030011 16-Deoxymyxinol 5alpha-Cholestane-3beta,7alpha,26-triol Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 420.36 C27H48O3
LMST04030179 16alpha,27-dihydroxycholesterol (25R)-cholest-5-en-3beta,16alpha,27-triol Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 418.34 C27H46O3
LMST04030265 20-Hydroxyecdysonic acid 6-oxo-2beta,3beta,14alpha,20R,22R,25-hexahydroxy-5beta-cholest-7-en-26-oic acid Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 510.28 C27H42O9
LMST04030008 27-Deoxy-5alpha-Cyprinol 5alpha-Cholestane-3alpha,7alpha,12alpha,26-tetrol Bile acids and derivatives [ST04] C27 bile acids, alcohols, and derivatives [ST0403] 436.36 C27H48O4