CHEBI:52023 - hyodeoxycholic acid

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ChEBI Name hyodeoxycholic acid ChEBI ID CHEBI:52023 Definition A member of the class of 5β-cholanic acids that is (5β)-cholan-24-oic acid substituted by α-hydroxy groups at positions 3 and 6. Stars This entity has been manually annotated by the ChEBI Team. Submitter Kristian Axelsen Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Wikipedia License Read full article at Wikipedia Formula C24H40O4 Net Charge 0 Average Mass 392.57200 Monoisotopic Mass 392.29266 InChI InChI=1S/C24H40O4/c1-14(4-7-22(27)28)17-5-6-18-16-13-21(26)20-12-15(25)8-10-24(20,3)19(16)9-11-23(17,18)2/h14-21,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15-,16+,17-,18+,19+,20+,21+,23-,24-/m1/s1 InChIKey DGABKXLVXPYZII-SIBKNCMHSA-N SMILES [H][C@@]1(CC[C@@]2([H])[C@]3([H])C[C@H](O)[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(O)=O Metabolite of Species Details Mus musculus (NCBI:txid10090) See: PubMed Homo sapiens (NCBI:txid9606) See: PubMed Homo sapiens (NCBI:txid9606) Found in blood serum (BTO:0000133). See: MetaboLights Study Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) Biological Role(s): human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). View more via ChEBI Ontology ChEBI Ontology Outgoing hyodeoxycholic acid (CHEBI:52023) has functional parent cholic acid (CHEBI:16359) hyodeoxycholic acid (CHEBI:52023) has role human metabolite (CHEBI:77746) hyodeoxycholic acid (CHEBI:52023) has role mouse metabolite (CHEBI:75771) hyodeoxycholic acid (CHEBI:52023) is a 5β-cholanic acids (CHEBI:36248) hyodeoxycholic acid (CHEBI:52023) is a 6α,20ξ-murideoxycholic acid (CHEBI:363227) hyodeoxycholic acid (CHEBI:52023) is a bile acid (CHEBI:3098) hyodeoxycholic acid (CHEBI:52023) is a C24-steroid (CHEBI:131620) hyodeoxycholic acid (CHEBI:52023) is conjugate acid of hyodeoxycholate (CHEBI:58875) Incoming hyodeoxycholic acid 24-O-(β-D-glucuronide) (CHEBI:137812) has functional parent hyodeoxycholic acid (CHEBI:52023) hyodeoxycholic acid 6-O-(β-D-glucuronide) (CHEBI:137822) has functional parent hyodeoxycholic acid (CHEBI:52023) hyodeoxycholate (CHEBI:58875) is conjugate base of hyodeoxycholic acid (CHEBI:52023) IUPAC Name 3α,6α-dihydroxy-5β-cholan-24-oic acid Synonyms Sources 3alpha,6alpha-Dihydroxy-5beta-cholanic acid SUBMITTER 3alpha,6alpha-Dihydroxy-5beta-cholanic acid KEGG COMPOUND 6alpha-Hydroxylithocholate SUBMITTER 6alpha-Hydroxylithocholate KEGG COMPOUND 7-Deoxyhyocholic acid ChemIDplus Hyodesoxycholic acid ChemIDplus Hyodesoxycholic acid KEGG COMPOUND Iodeoxycholic acid KEGG COMPOUND Manual Xrefs Databases C00030498 KNApSAcK C15517 KEGG COMPOUND CPD-7284 MetaCyc HMDB0000733 HMDB Hyodeoxycholic_acid Wikipedia LMST04010024 LIPID MAPS View more database links Registry Numbers Types Sources 3218394 Reaxys Registry Number Reaxys 3218394 Beilstein Registry Number Beilstein 83-49-8 CAS Registry Number ChemIDplus Citations Types Sources 18307294 PubMed citation Europe PMC 19711910 PubMed citation Europe PMC 23752203 PubMed citation Europe PMC 23756265 PubMed citation Europe PMC Last Modified 12 July 2017