CHEBI:136899 - chenodeoxycholic acid 24-O-(β-D-glucuronide)(1−)

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ChEBI Name chenodeoxycholic acid 24-O-(β-D-glucuronide)(1−) ChEBI ID CHEBI:136899 ChEBI ASCII Name chenodeoxycholic acid 24-O-(beta-D-glucuronide)(1-) Definition A steroid glucuronide anion that is the conjugate base of chenodeoxycholic acid 24-O-(β-D-glucuronide) arising from deprotonation of the carboxylic acid function; major species at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Submitter Nevila Nouspikel Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C30H47O10 Net Charge -1 Average Mass 567.689 Monoisotopic Mass 567.31747 InChI InChI=1S/C30H48O10/c1-14(4-7-21(33)39-28-25(36)23(34)24(35)26(40-28)27(37)38)17-5-6-18-22-19(9-11-30(17,18)3)29(2)10-8-16(31)12-15(29)13-20(22)32/h14-20,22-26,28,31-32,34-36H,4-13H2,1-3H3,(H,37,38)/p-1/t14-,15+,16-,17-,18+,19+,20-,22+,23+,24+,25-,26+,28-,29+,30-/m1/s1 InChIKey ZTJBLIAPAIPNJE-BWGRGVIUSA-M SMILES C1[C@@]2([C@]3(CC[C@]4([C@]([C@@]3([C@@H](C[C@@]2(C[C@@H](C1)O)[H])O)[H])(CC[C@@]4([C@@H](CCC(O[C@@H]5O[C@@H]([C@H]([C@@H]([C@H]5O)O)O)C([O-])=O)=O)C)[H])[H])C)[H])C ChEBI Ontology Outgoing chenodeoxycholic acid 24-O-(β-D-glucuronide)(1−) (CHEBI:136899) is a β-D-glucosiduronate (CHEBI:83411) chenodeoxycholic acid 24-O-(β-D-glucuronide)(1−) (CHEBI:136899) is a monocarboxylic acid anion (CHEBI:35757) chenodeoxycholic acid 24-O-(β-D-glucuronide)(1−) (CHEBI:136899) is a steroid glucosiduronic acid anion (CHEBI:136637) chenodeoxycholic acid 24-O-(β-D-glucuronide)(1−) (CHEBI:136899) is conjugate base of chenodeoxycholic acid 24-O-(β-D-glucuronide) (CHEBI:137790) Incoming chenodeoxycholic acid 24-O-(β-D-glucuronide) (CHEBI:137790) is conjugate acid of chenodeoxycholic acid 24-O-(β-D-glucuronide)(1−) (CHEBI:136899) IUPAC Name 1-O-(3α,7α-dihydroxy-24-oxo-5β-cholan-24-yl)-β-D-glucopyranuronate Synonyms Sources 1-O-[(3α,5β,7α)-3,7-dihydroxy-24-oxocholan-24-yl]-β-D-glucopyranuronate IUPAC CDCA-24G(1−) SUBMITTER chenodeoxycholoyl-24-O-(β-D-glucuronate) UniProt Citation Type Source 23756265 PubMed citation SUBMITTER Last Modified 11 July 2017