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Chemical Entities of Biological Interest Ontology
Last uploaded:
January 1, 2025
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| Preferred Name | nifedipine | |
| Synonyms |
Adapine Procardia Nifedipres nifedipinum Adalat Nifecor 4-(2'-Nitrophenyl)-2,6-dimethyl-1,4-dihydropyridin-3,5-dicarbonsaeuredimethylester nifedipino nifedipine Coracten Nifecard Nifedipine dimethyl 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_7565 |
|
| charge |
0
|
|
| database_cross_reference |
LINCS:LSM-4176 DrugBank:DB01115 Beilstein:497773 CAS:21829-25-4 Wikipedia:Nifedipine Drug_Central:1922 KEGG:D00437 KEGG:C07266
|
|
| formula |
C17H18N2O6
|
|
| has role |
http://purl.obolibrary.org/obo/CHEBI_35620 http://purl.obolibrary.org/obo/CHEBI_66993 |
|
| has_exact_synonym |
Nifedipine dimethyl 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
|
|
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
Adapine Procardia Nifedipres nifedipinum Adalat Nifecor 4-(2'-Nitrophenyl)-2,6-dimethyl-1,4-dihydropyridin-3,5-dicarbonsaeuredimethylester nifedipino nifedipine Coracten Nifecard
|
|
| id |
CHEBI:7565
|
|
| in_subset | ||
| inchi |
InChI=1S/C17H18N2O6/c1-9-13(16(20)24-3)15(14(10(2)18-9)17(21)25-4)11-7-5-6-8-12(11)19(22)23/h5-8,15,18H,1-4H3
|
|
| inchikey |
HYIMSNHJOBLJNT-UHFFFAOYSA-N
|
|
| label |
nifedipine
|
|
| mass |
346.33460
|
|
| monoisotopicmass |
346.11649
|
|
| notation |
CHEBI:7565
|
|
| prefLabel |
nifedipine
|
|
| smiles |
COC(=O)C1=C(C)NC(C)=C(C1c1ccccc1[N+]([O-])=O)C(=O)OC
|
|
| treeView |
http://purl.obolibrary.org/obo/CHEBI_50075 |
|
| subClassOf |
http://purl.obolibrary.org/obo/CHEBI_50075 |
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