Structure Database (LMSD)

LM_ID Common Name Systematic Name Main class Sub class Mass Formula
LMST04010001 Cholic acid 3Alpha,7Alpha,12Alpha-trihydroxy-5Beta-cholan-24-oic acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 408.29 C24H40O5
LMST04010475 Cholyl-CoA 3alpha,7alpha,12alpha-Trihydroxy-5beta-cholanoyl-CoA Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 1157.39 C45H74N7O20P3S
LMST04010062 Crichetocholic acid 3alpha,5beta,7alpha-Trihydroxycholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 408.29 C24H40O5
LMST04010411 Cygnocholic acid 3alpha,7alpha,15alpha-Trihydroxy-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 408.29 C24H40O5
LMST04010106 Dehydrocholic acid 3,7,12-Trioxo-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 402.24 C24H34O5
LMST04010127 Dehydrolithocholic Acid 3-Oxo-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 374.28 C24H38O3
LMST04010463 Dendronesterone D methyl 3-oxo,11alpha-acetoxy-chola-1,4,22E-triene-24-oate Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 440.26 C27H36O5
LMST04010464 Dendronesterone E methyl 3-oxo,11alpha-hydroxy-chola-1,4,22E-triene-24-oate Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 398.25 C25H34O4
LMST04010040 Deoxycholic acid 3alpha,12alpha-Dihydroxy-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 392.29 C24H40O4
LMST04010451 E-Petromylidene B 2-(E)-benzylidene-7alpha,12alpha,24-trihydroxy-5alpha-cholan-3-one-24-sulfate Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 560.28 C31H44O7S
LMST04010101 Haemulcholic acid (22S)-3alpha,7alpha,22-Trihydroxy-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 408.29 C24H40O5
LMST04010064 Hyocholic acid 3alpha,6alpha,7alpha-Trihydroxy-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 408.29 C24H40O5
LMST04010024 Hyodeoxycholic acid 3alpha,6alpha-Dihydroxy-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 392.29 C24H40O4
LMST04010034 Isochenodeoxycholic acid 3beta,7alpha-Dihydroxy-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 392.29 C24H40O4
LMST04010086 Isocholic acid 3beta,7alpha,12alpha-Trihydroxy-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 408.29 C24H40O5
LMST04010042 Isodeoxycholic acid 3beta,12alpha-Dihydroxy-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 392.29 C24H40O4
LMST04010026 Isohyodeoxycholic Acid 3beta,6alpha-Dihydroxy-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 392.29 C24H40O4
LMST04010004 Isolithocholic acid 3beta-Hydroxy-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 376.3 C24H40O3
LMST04010027 Isomurideoxycholic acid 3beta,6beta-Dihydroxy-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 392.29 C24H40O4
LMST04010035 Isoursodeoxycholic acid 3beta,7beta-Dihydroxy-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 392.29 C24H40O4
LMST04010090 Isoursodeoxycholic acid 3beta,7beta,12alpha-Trihydroxy-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 408.29 C24H40O5
LMST04010085 Lagocholic Acid 3alpha,7alpha,12beta-Trihydroxy-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 408.29 C24H40O5
LMST04010041 Lagodeoxycholic acid 3alpha,12beta-Dihydroxy-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 392.29 C24H40O4
LMST04010003 Lithocholic acid 3alpha-Hydroxy-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 376.3 C24H40O3
LMST04010025 Murideoxycholic acid 3alpha,6beta-Dihydroxy-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 392.29 C24H40O4
LMST04010476 Murideoxycholic acid 3-acetate 3alpha-acetyloxy-6beta-hydroxy-5beta-cholan-24-oic acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 434.3 C26H42O5
LMST04010477 Murideoxycholic acid 6-acetate 3alpha-hydroxy-6beta-acetyloxy-5beta-cholan-24-oic acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 434.3 C26H42O5
LMST04010465 Petasitosterone A methyl 3-oxo-12alpha-hydroxy-chola-1,4,22E-triene-24-oate Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 398.25 C25H34O4
LMST04010466 Petasitosterone B methyl 3-oxo-12alpha-acetoxy-chola-1,4,22E-triene-24-oate Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 440.26 C27H36O5
LMST04010450 Petromylidene A 2-(E)-(3-methylbutylidene)-7alpha,12alpha,24-trihydroxy-5alpha-cholan-3-one-24-sulfate Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 540.31 C29H48O7S
LMST04010453 Petromylidene C 2-(E)-ethylidene-7alpha,12alpha,24-trihydroxy-5alpha-cholan-3-one-24-sulfate Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 498.27 C26H42O7S
LMST04010301 Petromyzonol 5alpha-Cholane-3alpha,7alpha,12alpha,24-tetrol Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 394.31 C24H42O4
LMST04010102 Phocaecholic acid (23R)-3alpha,7alpha,23-Trihydroxy-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 408.29 C24H40O5
LMST04010111 Pythocholic acid 3alpha,12alpha,16alpha-Trihydroxy-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 408.29 C24H40O5
LMST04010088 Ursocholic acid 3alpha,7beta,12alpha-Trihydroxy-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 408.29 C24H40O5
LMST04010033 Ursodeoxycholic acid 3alpha,7beta-Dihydroxy-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 392.29 C24H40O4
LMST04010057 Vulpecholic acid 1alpha,3alpha,7alpha-Trihydroxy-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 408.29 C24H40O5
LMST04010452 Z-Petromylidene B 2-(Z)-benzylidene-7alpha,12alpha,24-trihydroxy-5alpha-cholan-3-one-24-sulfate Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 560.28 C31H44O7S
LMST04010066 alpha-muricholic acid 3alpha,6beta,7alpha-Trihydroxy-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 408.29 C24H40O5
LMST04010067 beta-muricholic acid 3alpha,6beta,7beta-Trihydroxy-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 408.29 C24H40O5
LMST04010442 chola-4,6-dien-24-oic acid chola-4,6-dien-24-oic acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 356.27 C24H36O2
LMST04010456 deoxycholoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[3alpha,12alpha-dihydroxy-5beta-cholan-24-oyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 1141.4 C45H74N7O19P3S
LMST04010065 omega-muricholic acid 3alpha,6alpha,7beta-Trihydroxy-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 408.29 C24H40O5
LMST04010226 7alpha,12alpha-Dihydroxy-5beta-chol-3-en-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 390.28 C24H38O4
LMST04010390 3alpha-Hydroxy-11,12-dioxo-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 404.26 C24H36O5
LMST04010389 3beta-Hydroxy-11-oxo-5beta-chol-8-en-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 388.26 C24H36O4
LMST04010387 3alpha-Hydroxy-12-oxo-5beta-chol-6-en-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 388.26 C24H36O4
LMST04010386 11beta,12beta-Dihydroxy-5beta-cholan-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 392.29 C24H40O4
LMST04010277 1,7-Dioxo-5beta-chol-2-en-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 386.25 C24H34O4
LMST04010394 3beta-Hydroxy-7-oxochol-5-en-24-oic Acid Bile acids and derivatives [ST04] C24 bile acids, alcohols, and derivatives [ST0401] 388.26 C24H36O4