loading...| Preferred Name |
methysergide |
|
| Synonyms |
Methysergide (8R)-N-[1-hydroxymethyl(propyl)]-1,6-dimethyl-9,10-didehydroergoline-8-carboxamide (+)-N-(1-(Hydroxymethyl)propyl)-1-methyl-D-lysergamide N-(1-(Hydroxymethyl)propyl)-1-methyl-dextro-(+)-lysergamide 9,10-Didehydro-N-(1-(hydroxymethyl)propyl)-1,6-dimethylergoline-8-carboxamide 1-Methyllysergic acid butanolamide metisergida methysergide 1-Methyl-dextro-lysergic acid (+)-1-hydroxy-2-butylamide 1-Methylmethylergonovine methysergidum 1-Methyl-D-lysergic acid butanolamide (+)-9,10-Didehydro-N-(1-(hydroxymethyl)propyl)-1,6-dimethylergoline-8beta-carboxamide |
|
| Definitions |
A synthetic ergot alkaloid, structurally related to the oxytocic agent methylergonovine and to the potent hallucinogen LSD and used prophylactically to reduce the frequency and intensity of severe vascular headaches. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_584020 |
|
| charge |
0 |
|
| database_cross_reference |
DrugBank:DB00247 KEGG:C07199 KEGG:D02357 Patent:GB854569 Patent:US3113133 CAS:361-37-5 Beilstein:765986 |
|
| definition |
A synthetic ergot alkaloid, structurally related to the oxytocic agent methylergonovine and to the potent hallucinogen LSD and used prophylactically to reduce the frequency and intensity of severe vascular headaches. |
|
| formula |
C21H27N3O2 |
|
| has parent hydride | ||
| has role |
http://purl.obolibrary.org/obo/CHEBI_66991 |
|
| has_alternative_id |
CHEBI:6893 |
|
| has_exact_synonym |
Methysergide (8R)-N-[1-hydroxymethyl(propyl)]-1,6-dimethyl-9,10-didehydroergoline-8-carboxamide |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
(+)-N-(1-(Hydroxymethyl)propyl)-1-methyl-D-lysergamide N-(1-(Hydroxymethyl)propyl)-1-methyl-dextro-(+)-lysergamide 9,10-Didehydro-N-(1-(hydroxymethyl)propyl)-1,6-dimethylergoline-8-carboxamide 1-Methyllysergic acid butanolamide metisergida methysergide 1-Methyl-dextro-lysergic acid (+)-1-hydroxy-2-butylamide 1-Methylmethylergonovine methysergidum 1-Methyl-D-lysergic acid butanolamide (+)-9,10-Didehydro-N-(1-(hydroxymethyl)propyl)-1,6-dimethylergoline-8beta-carboxamide |
|
| id |
CHEBI:584020 |
|
| in_subset | ||
| inchi |
InChI=1S/C21H27N3O2/c1-4-15(12-25)22-21(26)14-8-17-16-6-5-7-18-20(16)13(10-23(18)2)9-19(17)24(3)11-14/h5-8,10,14-15,19,25H,4,9,11-12H2,1-3H3,(H,22,26)/t14-,15?,19-/m1/s1 |
|
| inchikey |
KPJZHOPZRAFDTN-NQUBZZJWSA-N |
|
| label |
methysergide |
|
| mass |
353.45810 |
|
| monoisotopicmass |
353.21033 |
|
| notation |
CHEBI:584020 |
|
| prefLabel |
methysergide |
|
| smiles |
[H][C@@]12Cc3cn(C)c4cccc(C1=C[C@H](CN2C)C(=O)NC(CC)CO)c34 |
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| treeView | ||
| subClassOf |