Structure via PubChem · Public domain (PubChem)
deoxycholic acid
Sign in to saveAlso known as deoxycholate, 7α-deoxycholic acid, (3α,5β,12α)-3,12-dihydroxycholan-24-oic acid, Desoxycholsäure, desoxycholic acid, 3alpha,12alpha-Dihydroxy-5beta-cholanic acid
pharmaceutical drug
Chemical data
- Formula
- C24H40O4
- Molecular weight
- 392.6 g/mol
- IUPAC name
- (4R)-4-[(3R,5R,8R,9S,10S,12S,13R,14S,17R)-3,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
- SMILES
- C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C
- InChIKey
- KXGVEGMKQFWNSR-LLQZFEROSA-N
- XLogP
- 4.9
- Polar surface area
- 77.8 Ų
- H-bond donors
- 3
- H-bond acceptors
- 4
- Formal charge
- 0
via PubChem
Research
15,468 papers- Microbial metabolite deoxycholic acid-mediated ferroptosis exacerbates high-fat diet-induced colonic inflammation.Molecular metabolism · 2024
- Deoxycholic Acid (ATX-101) for Fat Reduction.Journal of drugs in dermatology : JDD · 2021
- Adverse Events of Injectable Deoxycholic Acid.Dermatologic surgery : official publication for American Society for Dermatologic Surgery [et al.] · 2020
- Deoxycholic acid in the submental fat reduction: A review of properties, adverse effects, and complications.Journal of cosmetic dermatology · 2020
- Deoxycholic Acid: A Review in Submental Fat Contouring.American journal of clinical dermatology · 2016
via PubMed
Wikidata facts
- Mass
- 392.292664
- Has use
- medication
Show 9 more facts
- chemical formula
- C₂₄H₄₀O₄
- canonical SMILES
- CC(CCC(=O)O)C1CCC2C1(C(CC3C2CCC4C3(CCC(C4)O)C)O)C
- isomeric SMILES
- C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C
- NCI Thesaurus ID
- C81042
- subject has role
- primary metabolite
- melting point
- 174
- found in taxon
- Homo sapiens
- Commons category
- Deoxycholic acid
- pKa
- 6.58
via Wikidata · CC0