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The Drug-Drug Interactions Ontology
Last uploaded:
February 11, 2016
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| Preferred Name | diphenoxylate | |
| Synonyms |
4-ethoxycarbonyl-alpha,alpha,4-triphenyl-1-piperidinebutyronitrile 1-(3-cyano-3,3-diphenylpropyl)-4-phenyl-isonipecotic acid ethyl ester ethyl 1-(3-cyano-3,3-diphenylpropyl)-4-phenyl-4-piperidinecarboxylate ethyl 1-(3-cyano-3,3-diphenylpropyl)-4-phenylisonipecotate C30H32N2O2 difenoxilato diphenoxylatum ethyl 1-(3-cyano-3,3-diphenylpropyl)-4-phenylpiperidine-4-carboxylate diphenoxylate 2,2-diphenyl-4-(4-carbethoxy-4-phenylpiperidino)butyronitrile |
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| ID |
http://purl.obolibrary.org/obo/CHEBI_4639 |
|
| activates | ||
| ATCCode |
A07DA01
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|
| binds | ||
| CASRN |
915-30-0
|
|
| DBBrand |
lomotil
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|
| DBname |
diphenoxylate
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|
| DBSynonym |
diphenoxylate hydrochloride difenoxilato [inn-spanish] difenossilato [dcit] diphenoxylatum [inn-latin] dea no. 9170 diphenoxalate
|
|
| Definition |
A piperidinecarboxylate ester that is the ethyl ester of difenoxin.
|
|
| has pharmacological target | ||
| has role | ||
| InChI |
InChI=1S/C30H32N2O2/c1-2-34-28(33)29(25-12-6-3-7-13-25)18-21-32(22-19-29)23-20-30(24-31,26-14-8-4-9-15-26)27-16-10-5-11-17-27/h3-17H,2,18-23H2,1H3
|
|
| InChIKey |
InChIKey=HYPPXZBJBPSRLK-UHFFFAOYSA-N
|
|
| label |
diphenoxylate
|
|
| modulates | ||
| prefixIRI |
obo2:CHEBI_4639
|
|
| prefLabel |
diphenoxylate
|
|
| SMILES |
CCOC(=O)C1(CCN(CC1)CCC(C#N)(c1ccccc1)c1ccccc1)c1ccccc1 CCOC(=O)C1(CCN(CCC(C#N)(C2=CC=CC=C2)C2=CC=CC=C2)CC1)C1=CC=CC=C1
|
|
| Synonym |
4-ethoxycarbonyl-alpha,alpha,4-triphenyl-1-piperidinebutyronitrile 1-(3-cyano-3,3-diphenylpropyl)-4-phenyl-isonipecotic acid ethyl ester ethyl 1-(3-cyano-3,3-diphenylpropyl)-4-phenyl-4-piperidinecarboxylate ethyl 1-(3-cyano-3,3-diphenylpropyl)-4-phenylisonipecotate C30H32N2O2 difenoxilato diphenoxylatum ethyl 1-(3-cyano-3,3-diphenylpropyl)-4-phenylpiperidine-4-carboxylate diphenoxylate 2,2-diphenyl-4-(4-carbethoxy-4-phenylpiperidino)butyronitrile
|
|
| xref |
PharmGKB:PA164746539 Wikipedia:http://en.wikipedia.org/wiki/Diphenoxylate ChemSpider:12919 Patent:US2898340 ChEMBL:775245 KEGG DRUG:D07861 PubChem Compound:13505 PubChem Substance:46507130 National Drug Code Directory:54868-0427-5 KEGG COMPOUND:C07872 RxList:http://www.rxlist.com/cgi/generic3/diphenoxylate.htm Wikipedia:Diphenoxylate DrugBank:DB01081 NIST Chemistry WebBook:915-30-0 CASRN:915-30-0 Beilstein:503374
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| subClassOf |
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