loading...| Preferred Name |
oxybutynin chloride |
|
| Synonyms |
4-(diethylamino)but-2-yn-1-yl cyclohexyl(hydroxy)phenylacetate hydrochloride 4-(Diethylamino)-2-butynyl alpha-phenylcyclohexaneglycolate hydrochloride 4-Diethylamino-2-butynyl phenyl(cyclohexyl)glycolate hydrochloride |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_7857 |
|
| charge |
0 |
|
| database_cross_reference |
DrugBank:DB01062 Beilstein:4833152 KEGG:D00722 CAS:1508-65-2 |
|
| formula |
C22H31NO3.HCl C22H32ClNO3 |
|
| has part | ||
| has_exact_synonym |
4-(diethylamino)but-2-yn-1-yl cyclohexyl(hydroxy)phenylacetate hydrochloride |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
4-(Diethylamino)-2-butynyl alpha-phenylcyclohexaneglycolate hydrochloride 4-Diethylamino-2-butynyl phenyl(cyclohexyl)glycolate hydrochloride |
|
| id |
CHEBI:7857 |
|
| in_subset | ||
| inchi |
InChI=1S/C22H31NO3.ClH/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;1H |
|
| inchikey |
SWIJYDAEGSIQPZ-UHFFFAOYSA-N |
|
| label |
oxybutynin chloride |
|
| mass |
393.94712 |
|
| monoisotopicmass |
393.20707 |
|
| notation |
CHEBI:7857 |
|
| prefLabel |
oxybutynin chloride |
|
| smiles |
[H+].[Cl-].CCN(CC)CC#CCOC(=O)C(O)(C1CCCCC1)c1ccccc1 |
|
| treeView | ||
| subClassOf |