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Neuroscience Information Framework (NIF) Standard Ontology
Last uploaded:
February 10, 2018
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| Id | http://purl.obolibrary.org/obo/CHEBI_44241
http://purl.obolibrary.org/obo/CHEBI_44241
|
|---|---|
| Preferred Name | 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.
|
| Synonyms |
Metopiron
metyraponum
metirapona
Metopirone
metyrapone
Metyrapone
2-methyl-1,2-dipyridin-3-ylpropan-1-one
METYRAPONE
|
| Type | http://www.w3.org/2002/07/owl#Class |
All Properties
| 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. |
|---|---|
| preferred label |
metyrapone
|
| label |
metyrapone
|
| prefLabel |
metyrapone
|
| database_cross_reference |
CAS:54-36-4
Patent:US2966493
DrugBank:DB01011
LINCS:LSM-3035
Beilstein:163023
Drug_Central:1791
PDBeChem:MYT
Wikipedia:Metyrapone
KEGG:C07205
KEGG:D00410
Reaxys:163023
See more
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|
| notation |
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
|
| has_related_synonym |
Metopiron
metyraponum
metirapona
Metopirone
metyrapone
|
| id |
CHEBI:44241
|
| note |
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.
|
| alternative label |
Metopiron
metyraponum
metirapona
Metopirone
metyrapone
Metyrapone
2-methyl-1,2-dipyridin-3-ylpropan-1-one
METYRAPONE
See more
See less
|
| charge |
0
|
| has_obo_namespace |
chebi_ontology
|
| formula |
C14H14N2O
|
| subClassOf | |
| inchikey |
FJLBFSROUSIWMA-UHFFFAOYSA-N
|
| mass |
226.27380
|
| monoisotopicmass |
226.11061
|
| has_alternative_id |
CHEBI:44238
CHEBI:6911
|
| type | |
| smiles |
CC(C)(C(=O)c1cccnc1)c1cccnc1
|
| has role | |
| has exact synonym |
Metyrapone
2-methyl-1,2-dipyridin-3-ylpropan-1-one
METYRAPONE
|
| has characteristic |
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