Preferred Name |
oxybutynin |
|
Synonyms |
rac-4-(diethylamino)but-2-yn-1-yl cyclohexyl(hydroxy)phenylacetate Oxybutynin oxibutinina oxybutynine oxybutyninum Ditropan ditropan kentera oxybutynin |
|
Definitions |
A racemate comprising equimolar amounts of (R)-oxybutynin and esoxybutynin. An antispasmodic used for the treatment of overactive bladder. |
|
ID |
http://purl.obolibrary.org/obo/CHEBI_7856 |
|
charge |
0 |
|
database_cross_reference |
Wikipedia:Oxybutynin Patent:GB940540 DrugBank:DB01062 CAS:5633-20-5 Beilstein:2707356 KEGG:D00465 KEGG:C07360 Drug_Central:2028 LINCS:LSM-5111 |
|
formula |
C22H31NO3 |
|
has part | ||
has role |
http://purl.obolibrary.org/obo/CHEBI_51371 http://purl.obolibrary.org/obo/CHEBI_53784 http://purl.obolibrary.org/obo/CHEBI_48876 http://purl.obolibrary.org/obo/CHEBI_36333 |
|
has_exact_synonym |
rac-4-(diethylamino)but-2-yn-1-yl cyclohexyl(hydroxy)phenylacetate Oxybutynin |
|
has_obo_namespace |
chebi_ontology |
|
has_related_synonym |
oxibutinina oxybutynine oxybutyninum Ditropan ditropan kentera oxybutynin |
|
has_RxCUI |
32675 |
|
id |
CHEBI:7856 |
|
in_subset | ||
inchi |
InChI=1S/C22H31NO3/c1-3-23(4-2)17-11-12-18-26-21(24)22(25,19-13-7-5-8-14-19)20-15-9-6-10-16-20/h5,7-8,13-14,20,25H,3-4,6,9-10,15-18H2,1-2H3 |
|
inchikey |
XIQVNETUBQGFHX-UHFFFAOYSA-N |
|
label |
oxybutynin |
|
mass |
357.494 |
|
monoisotopicmass |
357.23039 |
|
notation |
CHEBI:7856 |
|
prefixIRI |
CHEBI:7856 |
|
prefLabel |
oxybutynin |
|
smiles |
C1(CCCCC1)C(C2=CC=CC=C2)(C(OCC#CCN(CC)CC)=O)O |
|
textual definition |
A racemate comprising equimolar amounts of (R)-oxybutynin and esoxybutynin. An antispasmodic used for the treatment of overactive bladder. |
|
subClassOf |