ursodeoxycholic acid
A bile acid found in the bile of bears (Ursidae) as a conjugate with taurine. Used therapeutically, it prevents the synthesis and absorption of cholesterol and can lead to the dissolution of gallstones.
Exact Synonyms
3alpha,7beta-dihydroxy-5beta-cholan-24-oic acid
Ursodeoxycholic acid
Related Synonyms
(3alpha,5beta,7beta)-3,7-dihydroxycholan-24-oic acid
3alpha,7beta-Dihydroxy-5beta-cholan-24-oic acid
Actigall
Ursodeoxycholate
Ursodiol
class Information
charge
0
formula
C24H40O4
has_dbxref
- CAS:128-13-2
- DrugBank:DB01586
- Drug_Central:2797
- HMDB:HMDB0000946
- KEGG:C07880
- KEGG:D00734
- LINCS:LSM-6555
- LIPID_MAPS_instance:LMST04010033
- PMID:14989050
- PMID:17489439
- PMID:24816727
- Reaxys:3219888
- Wikipedia:Ursodiol
has_obo_namespace
chebi_ontology
inchi
InChI=1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17-,18+,19+,20+,22+,23+,24-/m1/s1
inchikey
RUDATBOHQWOJDD-UZVSRGJWSA-N
in_subset
mass
392.57200
monoisotopicmass
392.29266
smiles
[H][C@@]12C[C@H](O)CC[C@]1(C)[C@@]1([H])CC[C@]3(C)[C@]([H])(CC[C@@]3([H])[C@]1([H])[C@@H](O)C2)[C@H](C)CCC(O)=O
class Relations
Subclass of
Related from
has functional parent
is conjugate base of