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Substance
ID:1826720
Structure
Similarity
Functional Group
Text
ID:1364
ursodeoxycholic acid
Chemical Entities of Biological Interest
ID: CHEBI:9907
Names and Identifiers
IUPAC Traditional name
ursodeoxycholic acid
IUPAC name
(4R)-4-[(1R,3aS,3bR,4S,5aS,7R,9aS,9bS,11aR)-4,7-dihydroxy-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl]pentanoic acid
Synonyms
ursodeoxycholic acid
(3alpha,5beta,7beta)-3,7-dihydroxycholan-24-oic acid
3alpha,7beta-Dihydroxy-5beta-cholan-24-oic acid
Actigall
Ursodeoxycholate
Ursodeoxycholic acid
Ursodiol
Registration numbers
CAS Number
128-13-2
PubChem CID
31401
Beilstein Number
3219888
DrugBank ID
DB01586
KEGG ID
C07880
LINCS Database
LSM-6555
LIPID MAPS Instance
LMST04010033
PubMed Citation Links
14989050
24816727
17489439
Reaxys Registry
3219888
ACToR Database
128-13-2
BKMS React Database
23149
74685
4288
36312
2673
217849
BRENDA Database
1.1.1.357
1.1.1.21
1.1.1.213
1.1.1.50
1.1.1.149
1.1.1.270
1.3.1.20
1.3.1.3
2.3.1.65
2.8.2.34
2.4.1.B7
1.1.1.201
2.8.2.14
3.5.1.24
2.4.1.17
3.5.1.74
1.1.1.159
BRENDA Ligand Database
74685
2673
217849
4288
23149
36312
CHEMBL
CHEMBL1551
CompTox Database
DTXSID6023731
MetaboLights Database
MTBLS4431
MTBLS4463
MTBLS440
MTBLS547
MTBLS442
MTBLS670
MTBLS727
MTBLS1693
MTBLS2394
MTBLS2406
MTBLS136
MTBLS138
MTBLS2615
MTBLS135
MTBLS1257
MTBLS1259
MTBLS1295
MTBLS159
MTBLS204
MTBLS2017
MTBLS201
MTBLS3750
MTBLS406
MTBLS407
MTBLS2145
MTBLS1903
MTBLS220
MTBLS2187
SABIO-RK Database
11028
11030
7882
SureChEMBL Database
SCHEMBL27200
UniProt Database
Q04828
P52895
HMDB Database
HMDB0000946
Wikipedia Title
Ursodiol
Patent number
EP1321463
EP1652913
EP1886685
US2003104360
US2006122391
US2007197485
US2007253934
US2007265187
US2008057068
US2008076828
US2008076829
WO2007096431
US2007190140
WO2007103687
Drug Central Database
2,797
BindingDB Database
53721
KEGG DRUG Database
D00734
CHEBI ID
CHEBI:9907
PubChem SID
14718187
Properties
No Data Available
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Molecule Details
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.
Molecular Spectra
No Data Available
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References
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