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Biological and Environmental Research Ontology
Last uploaded:
December 23, 2022
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| Preferred Name | zolmitriptan | |
| Synonyms |
zolmitriptanum zolmitriptan 4-[[3-(2-dimethylaminoethyl)-1H-indol-5-yl]methyl]oxazolidin-2-one 311C90 Zipton Zomig Zomigoro Zominat (4S)-4-({3-[2-(dimethylamino)ethyl]-1H-indol-5-yl}methyl)-1,3-oxazolidin-2-one |
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| Definitions |
A member of the class of tryptamines that is N,N-dimethyltryptamine in which the hydrogen at position 5 of the indole ring has been replaced by a [(4S)-2-oxo-1,3-oxazolidin-4-yl]methyl group. A serotonin 5-HT1 B and D receptor agonist, it is used for the treatment of migraine. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_10124 |
|
| alternative term |
zolmitriptanum zolmitriptan 4-[[3-(2-dimethylaminoethyl)-1H-indol-5-yl]methyl]oxazolidin-2-one 311C90 Zipton Zomig Zomigoro Zominat (4S)-4-({3-[2-(dimethylamino)ethyl]-1H-indol-5-yl}methyl)-1,3-oxazolidin-2-one
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|
| bearer of |
http://purl.obolibrary.org/obo/CHEBI_35941 |
|
| charge |
0
|
|
| database_cross_reference |
CAS:139264-17-8 KEGG:C07218 LINCS:LSM-3208 KEGG:D00415 Drug_Central:2869 Beilstein:7415010 DrugBank:DB00315 Wikipedia:Zolmitriptan
|
|
| definition |
A member of the class of tryptamines that is N,N-dimethyltryptamine in which the hydrogen at position 5 of the indole ring has been replaced by a [(4S)-2-oxo-1,3-oxazolidin-4-yl]methyl group. A serotonin 5-HT1 B and D receptor agonist, it is used for the treatment of migraine.
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|
| formula |
C16H21N3O2
|
|
| has_exact_synonym |
(4S)-4-({3-[2-(dimethylamino)ethyl]-1H-indol-5-yl}methyl)-1,3-oxazolidin-2-one
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|
| has_functional_parent | ||
| has_obo_namespace |
chebi_ontology
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|
| has_related_synonym |
zolmitriptanum zolmitriptan 4-[[3-(2-dimethylaminoethyl)-1H-indol-5-yl]methyl]oxazolidin-2-one 311C90 Zipton Zomig Zomigoro Zominat
|
|
| id |
CHEBI:10124
|
|
| in_subset | ||
| inchi |
InChI=1S/C16H21N3O2/c1-19(2)6-5-12-9-17-15-4-3-11(8-14(12)15)7-13-10-21-16(20)18-13/h3-4,8-9,13,17H,5-7,10H2,1-2H3,(H,18,20)/t13-/m0/s1
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|
| inchikey |
ULSDMUVEXKOYBU-ZDUSSCGKSA-N
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|
| label |
zolmitriptan
|
|
| mass |
287.357
|
|
| monoisotopicmass |
287.16338
|
|
| notation |
CHEBI:10124
|
|
| prefLabel |
zolmitriptan
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|
| RO_0000087 |
http://purl.obolibrary.org/obo/CHEBI_35941 |
|
| smiles |
C1=C2C(=CNC2=CC=C1C[C@@H]3NC(=O)OC3)CCN(C)C
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| subClassOf |
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