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Biological and Environmental Research Ontology
Last uploaded:
December 23, 2022
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| Preferred Name | metyrapone | |
| Synonyms |
metyraponum Metopiron Metopirone metirapona metyrapone 2-methyl-1,2-dipyridin-3-ylpropan-1-one METYRAPONE Metyrapone |
|
| Definitions |
An aromatic ketone that is 3,3-dimethylbutan-2-one in which the methyl groups at positions 1 and 4 are replaced by pyridin-3-yl groups. A steroid 11beta-monooxygenase (EC 1.14.15.4) inhibitor, it is used in the diagnosis of adrenal insufficiency. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_44241 |
|
| alternative term |
metyraponum Metopiron Metopirone metirapona metyrapone 2-methyl-1,2-dipyridin-3-ylpropan-1-one METYRAPONE Metyrapone
|
|
| bearer of |
http://purl.obolibrary.org/obo/CHEBI_33295 |
|
| charge |
0
|
|
| database_cross_reference |
KEGG:C07205 Patent:US2966493 LINCS:LSM-3035 KEGG:D00410 Drug_Central:1791 Wikipedia:Metyrapone DrugBank:DB01011 PDBeChem:MYT Reaxys:163023 Beilstein:163023 CAS:54-36-4
|
|
| definition |
An aromatic ketone that is 3,3-dimethylbutan-2-one in which the methyl groups at positions 1 and 4 are replaced by pyridin-3-yl groups. A steroid 11beta-monooxygenase (EC 1.14.15.4) inhibitor, it is used in the diagnosis of adrenal insufficiency.
|
|
| formula |
C14H14N2O
|
|
| has_alternative_id |
CHEBI:44238 CHEBI:6911
|
|
| has_exact_synonym |
2-methyl-1,2-dipyridin-3-ylpropan-1-one METYRAPONE Metyrapone
|
|
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
metyraponum Metopiron Metopirone metirapona metyrapone
|
|
| id |
CHEBI:44241
|
|
| in_subset | ||
| inchi |
InChI=1S/C14H14N2O/c1-14(2,12-6-4-8-16-10-12)13(17)11-5-3-7-15-9-11/h3-10H,1-2H3
|
|
| inchikey |
FJLBFSROUSIWMA-UHFFFAOYSA-N
|
|
| label |
metyrapone
|
|
| mass |
226.27380
|
|
| monoisotopicmass |
226.11061
|
|
| notation |
CHEBI:44241
|
|
| prefLabel |
metyrapone
|
|
| RO_0000087 |
http://purl.obolibrary.org/obo/CHEBI_33295 |
|
| smiles |
CC(C)(C(=O)c1cccnc1)c1cccnc1
|
|
| subClassOf |
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