Structure Database (LMSD)

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LMSD: Lipid classification search results

C24 bile acids, alcohols, and derivatives [ST0401]

LM_ID Common Name Systematic Name Species Shorthand Formula Mass
LMST05040020 Taurolagocholate-3-sulfate N-(3alpha,7alpha,12beta-Trihydroxy-5beta-cholan-24-oyl)-taurine 3-sulfate C26H45NO10S2 595.248493
LMST05010023 Glycocholic acid 3-glucuronide N-(3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-24-oyl)-glycine 3-D-glucuronide C32H51NO12 641.341129
LMST05040009 Taurolithocholic acid 3-glucuronide N-(3alpha-hydroxy-5beta-cholan-24-oyl)-taurine 3-beta-D-glucuronide C32H53NO11S 659.333936
LMST05020003 Taurolithocholate sulfate N-(3alpha-hydroxy-5beta-cholan-24-oyl)-taurine 3-sulfate C26H45NO8S2 563.258663
LMST05020030 Taurochenodeoxycholic acid 7-sulfate N-(3alpha,7alpha-dihydroxy-5beta-cholan-24-oyl)-taurine 7-sulfate C26H45NO9S2 579.253578
LMST05020031 Taurocholic acid 3-sulfate N-(3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-24-oyl)-taurine 3-sulfate C26H45NO10S2 595.248493
LMST05030004 Sulfoglycolithocholate N-(3alpha-hydroxy-5beta-cholan-24-oyl)-glycine 3-sulfate C26H43NO7S 513.276026
LMST05030005 glycochenodeoxycholic acid 7-sulfate N-[3alpha-hydroxy-24-oxo-7alpha-(sulfooxy)-5beta-cholan-24-yl]glycine C26H43NO8S 529.270941
LMST05030010 N-[(3a,5b,7a,12a)-3,12-dihydroxy-24-oxo-7-(sulfoxy)cholan-24-yl]-Glycine C26H43NO9S 545.265856
LMST05030011 N-[(3a,5b,7a,12a)-3,7-dihydroxy-24-oxo-12-(sulfoxy)cholan-24-yl]-Glycine C26H43NO9S 545.265856
LMST05030012 N-[(3a,5b,7b)-7-hydroxy-24-oxo-3-(sulfoxy)cholan-24-yl]-Glycine C26H43NO8S 529.270941
LMST05010048 Glycochenodeoxycholic acid 3-glucuronide C32H51NO11 625.346214
LMST05040001 Taurocholic acid N-(3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-24-oyl)-taurine ST 24:1;O4;Tau C26H45NO7S 515.291676
LMST05040022 N-(7alpha-Hydroxy-3-oxochol-4-en-24-oyl)-taurine N-(7alpha-Hydroxy-3-oxochol-4-en-24-oyl)-taurine ST 24:3;O3;Tau C26H41NO6S 495.265461
LMST05040021 N-(3alpha,7alpha,15alpha-Trihydroxy-5beta-cholan-24-oyl)-taurine ST 24:1;O4;Tau C26H45NO7S 515.291676
LMST05040016 Taurallocholic acid N-(3alpha,7alpha,12alpha-trihydroxy-5alpha-cholan-24-oyl)-taurine ST 24:1;O4;Tau C26H45NO7S 515.291676
LMST05040015 Tauroursodeoxycholic acid N-(3alpha,7beta-dihydroxy-5beta-cholan-24-oyl)-taurine ST 24:1;O3;Tau C26H45NO6S 499.296761
LMST05040014 Tauroursocholic acid N-(3alpha,7beta,12alpha-trihydroxy-5beta-cholan-24-oyl)-taurine ST 24:1;O4;Tau C26H45NO7S 515.291676
LMST05040013 Taurodeoxycholic acid N-(3alpha,12alpha-dihydroxy-5beta-cholan-24-oyl)-taurine ST 24:1;O3;Tau C26H45NO6S 499.296761
LMST05040012 Tauro-beta-muricholic acid N-(3alpha,6beta,7beta-trihydroxy-5beta-cholan-24-oyl)-taurine ST 24:1;O4;Tau C26H45NO7S 515.291676
LMST05040010 Taurohyocholic acid N-(3alpha,6alpha,7alpha-Trihydroxy-5beta-cholan-24-oyl)-taurine ST 24:1;O4;Tau C26H45NO7S 515.291676
LMST05040005 Taurochenodeoxycholic acid N-(3alpha,7alpha-dihydroxy-5beta-cholan-24-oyl)-taurine ST 24:1;O3;Tau C26H45NO6S 499.296761
LMST05030020 N-(7alpha-Hydroxy-3-oxochol-4-en-24-oyl)-glycine N-(7alpha-Hydroxy-3-oxochol-4-en-24-oyl)-glycine ST 24:3;O3;Gly C26H39NO5 445.282824
LMST05030019 3beta,5alpha,6beta-Trihydroxy-cholanoyl-glycine N-(3beta,5alpha,6beta,trihydroxycholestan-24-oyl) glycine ST 24:1;O4;Gly C26H43NO6 465.309039
LMST05030018 3beta-Hydroxy-7-oxochol-5-en-24-oyl-glycine N-(3beta-hydroxy-7-oxocholest-5-en-24-oyl) glycine ST 24:3;O3;Gly C26H39NO5 445.282824
LMST05030017 N-(3beta,7beta,dihydroxycholest-5-en-24-oyl) glycine N-(3beta,7beta,dihydroxycholest-5-en-24-oyl) glycine ST 24:2;O3;Gly C26H41NO5 447.298474
LMST05030016 Glycoursodeoxycholic acid N-(3alpha,7beta-dihydroxy-5beta-cholan-24-oyl)-glycine ST 24:1;O3;Gly C26H43NO5 449.314124
LMST05030001 Glycocholic Acid N-(3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-24-oyl)-glycine ST 24:1;O4;Gly C26H43NO6 465.309039
LMST05030007 3a,7b,12a-Trihydroxyoxocholanyl-Glycine N-(3alpha,7beta,12alpha-trihydroxy-5beta-cholan-24-oyl)-glycine ST 24:1;O4;Gly C26H43NO6 465.309039
LMST05010044 Cholic acid glucuronide 3alpha-[(beta-D-Glucopyranuronosyl)oxy]-7alpha,12alpha-dihydroxy-5beta-cholanoic acid ST 24:1;O5;GlcA C30H48O11 584.319665
LMST05010046 Deoxycholic acid 3-glucuronide ST 24:1;O4;GlcA C30H48O10 568.324750
LMST04010463 Dendronesterone D methyl 3-oxo,11alpha-acetoxy-chola-1,4,22E-triene-24-oate ST 27:6;O5 C27H36O5 440.256275
LMST04010464 Dendronesterone E methyl 3-oxo,11alpha-hydroxy-chola-1,4,22E-triene-24-oate ST 25:5;O4 C25H34O4 398.245710
LMST04010465 Petasitosterone A methyl 3-oxo-12alpha-hydroxy-chola-1,4,22E-triene-24-oate ST 25:5;O4 C25H34O4 398.245710
LMST04010466 Petasitosterone B methyl 3-oxo-12alpha-acetoxy-chola-1,4,22E-triene-24-oate ST 27:6;O5 C27H36O5 440.256275
LMST05040023 N-methyltaurocholic acid 3α,7α,12α-trihydroxy-5β-cholan-24-oyl-N-methyltaurine C27H47NO7S 529.307326
LMST05040024 N-methyltaurodeoxycholic acid 3α,12α-dihydroxy-5β-cholan-24-oyl-N-methyltaurine C27H47NO6S 513.312411
LMST04010467 BA-delta5-3beta,7beta-diol 7betaGlcNAc 3beta-Hydroxy-7beta-N-acetylglucosaminylchol-5-en-24-oic acid C31H49NO10 595.335649
LMST04010468 BA-delta5-3beta,7beta-diol 3betaS,7betaGlcNAc 3beta-Sulfooxy-7beta-N-acetylglucosaminylchol-5-en-24-oic acid C31H49NO13S 675.292466
LMST04010469 BA-delta5-3beta,7beta-diol 3betaS,7betaGlcNAc,24T 3beta-Sulfooxy-7beta-N-acetylglucosaminylchol-5-en-24-oyltaurine C33H54N2O15S2 782.296567
LMST04010470 BA-delta5-3beta,7beta-diol 3betaS,7betaGlcNAc,24G 3beta-Sulfooxy-7beta-N-acetylglucosaminylchol-5-en-24-oylglycine C33H52N2O14S 732.313930
LMST04010471 BA-delta5-3beta,7beta-diol 7betaGlcNAc,24G 3beta-hydroxy-7beta-N-acetylglucosaminylchol-5-en-24-oylglycine C33H52N2O11 652.357113
LMST04010472 BA-delta5-3beta,7beta-diol,7betaGlcNAc,24T 3beta-hydroxy-7beta-N-acetylglucosaminylchol-5-en-24-oyltaurine C33H54N2O12S 702.339750
LMST05030021 Glycohyocholic acid N-(3alpha,6alpha,7alpha-Trihydroxy-5beta-cholan-24-oyl)-glycine ST 24:1;O4;Gly C26H43NO6 465.309039
LMST05050051 SNAG-delta5-CA 3beta-sulfooxy-7beta-N-acetylglucosaminyl-5-cholen-24-oic acid C32H51NO12S 673.313201
LMST05050052 SNAG-delta5-CG 3beta-sulfooxy-7beta-N-acetylglucosaminyl-5-cholen-24-oyl glycine C34H54N2O13S 730.334665
LMST05050053 SNAG-delta5-CT 3beta-sulfooxy-7beta-N-acetylglucosaminyl-5-cholen-24-oyl taurine C34H56N2O14S2 780.317302
LMST05050056 Phenylalanocholic Acid N-(3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-24-oyl)-L-phenylalanine ST 24:1:O4;Phe C33H49NO6 555.355989
LMST05050057 Tyrosocholic Acid N-(3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-24-oyl)-L-tyrosine ST 24:1:O4;Tyr C33H49NO7 571.350904
LMST05050058 Leucocholic Acid N-(3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-24-oyl)-L-leucine ST 24:1:O4;Leu C30H51NO6 521.371639