| 2D Structure | |
| CID | 8226 |
| IUPAC Name | (6aR,9R)-N-[(2S)-1-hydroxybutan-2-yl]-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide |
| InChI | InChI=1S/C20H25N3O2/c1-3-14(11-24)22-20(25)13-7-16-15-5-4-6-17-19(15)12(9-21-17)8-18(16)23(2)10-13/h4-7,9,13-14,18,21,24H,3,8,10-11H2,1-2H3,(H,22,25)/t13-,14+,18-/m1/s1 |
| InChI Key | UNBRKDKAWYKMIV-QWQRMKEZSA-N |
| Canonical SMILES | None |
| Isomeric SMILES | None |
| Molecular Formula | C20H25N3O2 |
| Molecular Weight | 339.4 |
| synonyms | ['methylergonovine', 'Methylergometrine', 'Methylergobasin', 'Methylergobasine', 'Methylergobrevin', 'Methylergometrin', 'Methylergonovin', 'Partergin', '113-42-8', 'Basofortina', 'Ergotyl', 'Metilergometrina', 'Methergin', 'Methylergometrinum', 'Ergometrine, methyl-', 'D-Lysergic acid-(+)-butanolamide-(2)', 'N-(alpha-(Hydroxymethyl)propyl)-D-lysergamide', 'W53L6FE61V', '(6aR,9R)-N-[(2S)-1-hydroxybutan-2-yl]-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide', 'D-lysergic acid 1-butanolamide', 'DTXCID303283', 'DTXSID00904978', 'Ergoline-8-beta-carboxamide, 9,10-didehydro-N-((S)-1-(hydroxymethyl)propyl)-6-methyl-', '(4R,7R)-N-((2S)-1-hydroxybutan-2-yl)-6-methyl-6,11-diazatetracyclo(7.6.1.0^(2,7).0^(12,16))hexadeca-1(16),2,9,12,14-pentaene-4-carboxamide', '(4R,7R)-N-[(2S)-1-hydroxybutan-2-yl]-6-methyl-6,11-diazatetracyclo[7.6.1.0^{2,7}.0^{12,16}]hexadeca-1(16),2,9,12,14-pentaene-4-carboxamide', '(6aR,9R)-N-((2S)-1-hydroxybutan-2-yl)-7-methyl-6,6a,8,9-tetrahydro-4H-indolo(4,3-fg)quinoline-9-carboxamide', 'RefChem:55613', '9,10-Didehydro-N-(1-(hydroxymethyl)-propyl)-D-lysergamide', '9,10-Didehydro-N-[1-(hydroxymethyl)-propyl]-D-lysergamide', 'G02AB01', '(4R,7R)-N-((2S)-1-hydroxybutan-2-yl)-6-methyl-6,11-diazatetracyclo(7.6.1.02,7.012,16)hexadeca-1(16),2,9,12,14-pentaene-4-carboxamide', '204-027-0', 'Metrol', 'Methergen', 'Methylergometrine maleate', 'Methylergometrine (INN)', 'CHEMBL1201356', 'ME 277', 'NCGC00017258-04', 'Metilergometrinio', 'Metilergometrina [DCIT]', '(8beta)-N-[(2S)-1-hydroxybutan-2-yl]-6-methyl-9,10-didehydroergoline-8-carboxamide', 'Lysergic acid butanolamide', 'METHYLERGOMETRINE [INN]', 'Methylergometrine [INN:BAN]', 'Lysergamide, N-((S)-1-(hydroxymethyl)propyl)-', 'Methylergometrinum [INN-Latin]', 'Metilergometrinio [INN-Spanish]', 'Ergotyl (TN)', 'D-Lysergic acid-dl-hydroxybutylamide-2', 'HSDB 3364', 'EINECS 204-027-0', 'UNII-W53L6FE61V', 'CAS-113-42-8', 'H8D', '9,10-Didehydro-N-(1-(hydroxymethyl)propyl)-6-methylergoline-8-carboxamide', '9,10-Didehydro-N-(alpha-(hydroxymethyl)propyl)-6-methyl-ergoline-8-beta-carboxamide', 'Spectrum_000263', 'Prestwick3_000374', 'Spectrum2_000613', 'Spectrum3_000502', 'Spectrum5_001879', 'Biomol-NT_000154', 'Ergoline-8-carboxamide, 9,10-didehydro-N-(1-(hydroxymethyl)propyl)-6-methyl-, (8beta(S))-', 'Lopac0_000794', 'SCHEMBL78176', 'BSPBio_000527', 'BSPBio_002023', 'GTPL150', 'KBioSS_000743', 'METHYLERGONOVINE [MI]', 'DivK1c_000357', 'SPBio_000546', 'BPBio1_000442', 'BPBio1_000581', 'METHYLERGOMETRINE [HSDB]', 'METHYLERGONOVINE [VANDF]', 'SCHEMBL29368336', 'CHEBI:92607', 'KBio1_000357', 'KBio2_000743', 'KBio2_003311', 'KBio2_005879', 'KBio3_001523', 'NINDS_000357', 'UNBRKDKAWYKMIV-QWQRMKEZSA-N', 'METHYLERGOMETRINE [WHO-DD]', 'Tox21_110809', 'BDBM50330860', 'EBC-26652', 'Tox21_110809_1', 'CCG-204878', 'DB00353', 'SDCCGSBI-0050771.P005', '(8beta)-N-[(1S)-1-(hydroxymethyl)propyl]-6-methyl-9,10-didehydroergoline-8-carboxamide', 'IDI1_000357', 'NCGC00017258-03', 'NCGC00017258-05', 'NCGC00017258-06', 'NCGC00017258-08', 'NCGC00017258-12', 'NCGC00024646-02', 'NCGC00024646-03', 'DA-75495', 'SBI-0050771.P004', 'AB00514664', 'CS-0647098', 'NS00023683', 'D08207', 'AB00053497_03', 'EN300-6481358', 'Q424477', 'ERGOMETRINE MALEATE IMPURITY D [EP IMPURITY]', 'BRD-K34685430-001-01-1', 'BRD-K34685430-050-04-2', 'BRD-K34685430-050-06-7', 'BRD-K34685430-050-11-7', 'BRD-K34685430-050-12-5', '(8|A)-9,10-Didehydro-N-[(1S)-1-(hydroxymethyl)propyl]-6-methylergoline-8-carboxamide', 'N-[(2S)-1-Hydroxybutan-2-yl]-6-methyl-9,10-didehydroergoline-8beta-carboxamide', '(4R,7R)-N-[(2S)-1-hydroxybutan-2-yl]-6-methyl-6,11-diazatetracyclo[7.6.1.0^{2,7}.0^{12,16}]hexadeca-1(15),2,9,12(16),13-pentaene-4-carboxamide', '(6aR,9R)-N-((S)-1-hydroxybutan-2-yl)-7-methyl-4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinoline-9-carboxamide', '(8.BETA.)-N-((1S)-1-(HYDROXYMETHYL)PROPYL)-6-METHYL-9,10-DIDEHYDROERGOLINE-8-CARBOXAMIDE'] |
From Pubchem