loading...| Preferred Name |
metergoline |
| Synonyms |
metergolinum D-8-beta-((Carboxyamino)methyl)-1,6-dimethylergoline benzyl ester (((8-beta)-1,6-Dimethylergolin-8-yl)methyl)carbamic acid phenylmethyl ester D-8-beta-((Carbobenzoxyamino)methyl)-1,6-dimethyl-10-alpha-ergoline 1-Methyl-N-carbobenzyloxydihydro-D-lysergamin 1,6-Dimethyl-8-beta-carbobenzyloxaminomethyl-10-alpha-ergoline metergoline Metergolin (+)-N-(Carboxy)-1-methyl-9,10-dihydrolysergamine benzyl ester (((8-beta)-1,6-Dimethylergolin-8-yl)methyl)carbamic acid benzyl ester benzyl {[(8alpha)-1,6-dimethylergolin-8-yl]methyl}carbamate 1-Methyl-8-beta-carbobenzyloxyaminomethyl-10-alpha-ergoline metergolina |
| Definitions |
An ergoline alkaloid that is the N-benzyloxycarbonyl derivative of lysergamine. A 5-HT2 antagonist. Also 5-HT1 antagonist and 5-HT1D ligand. Has moderate affinity for 5-HT6 and high affinity for 5-HT7. |
| ID |
http://purl.obolibrary.org/obo/CHEBI_64216 |
| charge |
0 |
| database_cross_reference |
Wikipedia:Metergoline PMID:19509219 PMID:21880033 PMID:21600959 PMID:19538518 PMID:20845263 CAS:17692-51-2 PMID:20377624 PMID:19632276 PMID:22218419 PMID:18996971 PMID:19945477 PMID:24134630 Drug_Central:1723 PMID:19484723 PMID:20451398 PMID:19539656 KEGG:D07218 Reaxys:5362415 PMID:21475142 PMID:21354537 LINCS:LSM-3265 |
| definition |
An ergoline alkaloid that is the N-benzyloxycarbonyl derivative of lysergamine. A 5-HT2 antagonist. Also 5-HT1 antagonist and 5-HT1D ligand. Has moderate affinity for 5-HT6 and high affinity for 5-HT7. |
| formula |
C25H29N3O2 |
| has role |
http://purl.obolibrary.org/obo/CHEBI_48279 |
| has_exact_synonym |
benzyl {[(8alpha)-1,6-dimethylergolin-8-yl]methyl}carbamate |
| has_obo_namespace |
chebi_ontology |
| has_related_synonym |
metergolinum D-8-beta-((Carboxyamino)methyl)-1,6-dimethylergoline benzyl ester (((8-beta)-1,6-Dimethylergolin-8-yl)methyl)carbamic acid phenylmethyl ester D-8-beta-((Carbobenzoxyamino)methyl)-1,6-dimethyl-10-alpha-ergoline 1-Methyl-N-carbobenzyloxydihydro-D-lysergamin 1,6-Dimethyl-8-beta-carbobenzyloxaminomethyl-10-alpha-ergoline metergoline Metergolin (+)-N-(Carboxy)-1-methyl-9,10-dihydrolysergamine benzyl ester (((8-beta)-1,6-Dimethylergolin-8-yl)methyl)carbamic acid benzyl ester 1-Methyl-8-beta-carbobenzyloxyaminomethyl-10-alpha-ergoline metergolina |
| id |
CHEBI:64216 |
| in_subset | |
| inchi |
InChI=1S/C25H29N3O2/c1-27-14-18(13-26-25(29)30-16-17-7-4-3-5-8-17)11-21-20-9-6-10-22-24(20)19(12-23(21)27)15-28(22)2/h3-10,15,18,21,23H,11-14,16H2,1-2H3,(H,26,29)/t18-,21+,23+/m0/s1 |
| inchikey |
WZHJKEUHNJHDLS-QTGUNEKASA-N |
| label |
metergoline |
| mass |
403.51670 |
| monoisotopicmass |
403.22598 |
| notation |
CHEBI:64216 |
| prefLabel |
metergoline |
| smiles |
[H][C@@]12Cc3cn(C)c4cccc(c34)[C@@]1([H])C[C@@H](CNC(=O)OCc1ccccc1)CN2C |
| treeView | |
| subClassOf |