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The Drug Ontology
| Preferred Name | loratadine | |
| Synonyms |
loratadinum 4-(8-chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)-1-piperidinecarboxylic acid ethyl ester Aerotina Alarin Alavert Alerpriv Allerclear Civeran Claratyne Claritin Loracert Loradamed Loradex Lorastine Loratyne Wal-itin loratadina loratadine ethyl 4-(8-chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)piperidine-1-carboxylate |
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| Definitions |
A benzocycloheptapyridine that is 6,11-dihydro-5H-benzo[5,6]cyclohepta[1,2-b]pyridine substituted by a chloro group at position 8 and a 1-(ethoxycarbonyl)piperidin-4-ylidene group at position 11. It is a H1-receptor antagonist commonly employed in the treatment of allergic disorders. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_6538 |
|
| alternative label |
loratadinum 4-(8-chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)-1-piperidinecarboxylic acid ethyl ester Aerotina Alarin Alavert Alerpriv Allerclear Civeran Claratyne Claritin Loracert Loradamed Loradex Lorastine Loratyne Wal-itin loratadina loratadine ethyl 4-(8-chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)piperidine-1-carboxylate
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|
| charge |
0
|
|
| database_cross_reference |
PMID:7522069 HMDB:HMDB0005000 PMID:31576110 PMID:33963858 PMID:15627436 PMID:32312261 Wikipedia:Loratadine FooDB:FDB023577 PMID:32694422 PMID:33673552 Reaxys:4273483 Chemspider:3820 PMID:33550204 PMID:31315424 PMID:34306392 PMID:24134630 CAS:79794-75-5 PMID:32877950 DrugBank:DB00455 KEGG:D00364 PMID:34121623 Drug_Central:1605 LINCS:LSM-5891
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|
| definition |
A benzocycloheptapyridine that is 6,11-dihydro-5H-benzo[5,6]cyclohepta[1,2-b]pyridine substituted by a chloro group at position 8 and a 1-(ethoxycarbonyl)piperidin-4-ylidene group at position 11. It is a H1-receptor antagonist commonly employed in the treatment of allergic disorders.
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|
| formula |
C22H23ClN2O2
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|
| has functional parent | ||
| has role |
http://purl.obolibrary.org/obo/CHEBI_37955 http://purl.obolibrary.org/obo/CHEBI_48873 |
|
| has_alternative_id |
CHEBI:94763
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|
| has_exact_synonym |
ethyl 4-(8-chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)piperidine-1-carboxylate
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|
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
loratadinum 4-(8-chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)-1-piperidinecarboxylic acid ethyl ester Aerotina Alarin Alavert Alerpriv Allerclear Civeran Claratyne Claritin Loracert Loradamed Loradex Lorastine Loratyne Wal-itin loratadina loratadine
|
|
| has_RxCUI |
28889
|
|
| id |
CHEBI:6538
|
|
| in_subset | ||
| inchi |
InChI=1S/C22H23ClN2O2/c1-2-27-22(26)25-12-9-15(10-13-25)20-19-8-7-18(23)14-17(19)6-5-16-4-3-11-24-21(16)20/h3-4,7-8,11,14H,2,5-6,9-10,12-13H2,1H3
|
|
| inchikey |
JCCNYMKQOSZNPW-UHFFFAOYSA-N
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|
| label |
loratadine
|
|
| mass |
382.890
|
|
| monoisotopicmass |
382.14481
|
|
| notation |
CHEBI:6538
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|
| prefLabel |
loratadine
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|
| smiles |
CCOC(=O)N1CCC(CC1)=C1C2=C(CCC3=C1N=CC=C3)C=C(Cl)C=C2
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|
| subClassOf |
http://purl.obolibrary.org/obo/CHEBI_48593 http://purl.obolibrary.org/obo/CHEBI_140326 http://purl.obolibrary.org/obo/CHEBI_36683 |
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