Compound Details

 Compound-ID 7935
 Common Name Taurochenodeoxycholate
 Synonyms Chenodeoxycholoyltaurine
 InChI InChI=1S/C26H45NO6S/c1-16(4-7-23(30)27-12-13-34(31,32)33)19-5-6-20-24-21(9-11-26(19,20)3)25(2)10-8-18(28)14-17(25)15-22(24)29/h16-22,24,28-29H,4-15H2,1-3H3,(H,27,30)(H,31,32,33)/p-1/t16-,17+,18-,19-,20+,21+,22-,24+,25+,26-/m1/s1
 SMILES [H]C14(CC(O)CCC4(C)(C2CCC3(C)(C(CCC3(C2(C(O)C1)))C(C)CCC(=O)NCCS(O)(=O)=O)))
 External Links
 KEGG-COMPOUND-ID C05465
 PUBCHEM-ID 7825
 ChEBI-ID 16525
9407
 METACYC-ID CPD-7283
 METANETX-ID MNXM731822
 BioModels 16525
9407


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