Compound Details

 Compound-ID 6585
 Common Name Bilirubin-glucuronoside
 Synonyms Bilirubin monoglucuronide
BMGa
 InChI InChI=1S/C39H44N4O12/c1-7-20-19(6)36(50)43-27(20)14-25-18(5)23(10-12-31(46)54-39-34(49)32(47)33(48)35(55-39)38(52)53)29(41-25)15-28-22(9-11-30(44)45)17(4)24(40-28)13-26-16(3)21(8-2)37(51)42-26/h7-8,13-14,32-35,39-41,47-49H,1-2,9-12,15H2,3-6H3,(H,42,51)(H,43,50)(H,44,45)(H,52,53)/b26-13+,27-14+/t32-,33-,34+,35-,39+/m0/s1
 SMILES C=CC=5C(=O)NC(=Cc4nc(Cc3nc(C=C1NC(=O)C(C)=C1(C=C))c(C)c3(CCC(=O)OC2OC(C(O)=O)C(O)C(O)C2(O)))c(CCC(O)=O)c4(C))C=5(C)
 External Links
 KEGG-COMPOUND-ID C03374
 PUBCHEM-ID 6209
 ChEBI-ID 16427
57767
3101
22874
13900
 REACTOME-ID 159160
 METACYC-ID BILIRUBIN-GLUCURONOSIDE
 METANETX-ID MNXM728229
 BioModels 16427


View all entries for compound: Bilirubin-glucuronoside




© HITS gGmbH