| Formula |
C20H25N3O2 |
| IUPAC Name |
(6ar,7r,9r)-n-[(1s)-1-(hydroxymethyl)propyl]-7-methyl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-4-ium-9-carboxamide |
| Molecular Mass |
339.431 g·mol−1 |
| Heat of Formation |
-153.0 ± 16.7 kJ·mol−1 |
| Dipole Moment |
2.89 ± 1.08 D |
| Volume |
414.86 Å 3 |
| Surface Area |
362.86 Å 2 |
| HOMO Energy |
-8.29 ± 0.55 eV |
| LUMO Energy |
-0.31 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- (8beta)-n-[(1s)-1-(hydroxymethyl)propyl]-6-methyl-9,10-didehydroergoline-8-carboxamide
- 9,10-didehydro-n-(1-(hydroxymethyl)propyl)-6-methylergoline-8-carboxamide
- 9,10-didehydro-n-(alpha-(hydroxymethyl)propyl)-6-methyl-ergoline-8-beta-carboxamide
- basofortina
- biomol-nt_000154
- bpbio1_000442
- bpbio1_000581
- d-lysergic acid-(+)-butanolamide-(2)
- d-lysergic acid-dl-hydroxybutylamide-2
- ergoline-8-beta-carboxamide, 9,10-didehydro-n-((s)-1-(hydroxymethyl)propyl)-6-methyl-
- ergoline-8-carboxamide, 9,10-didehydro-n-(1-(hydroxymethyl)propyl)-6-methyl-, (8beta(s))-
- ergometrine, methyl-
- lysergamide, n-((s)-1-(hydroxymethyl)propyl)-
- lysergic acid butanolamide
- me 277
- methergen
- methylergobasin
- methylergobasine
- methylergobrevin
- methylergometrin
- methylergonovin
- methylergonovine
- metilergometrina [dcit]
- n-(alpha-(hydroxymethyl)propyl)-d-lysergamide
- partergin
|
| CAS Number(s) |
- 29477-86-9
- 29589-73-9
- 479-03-8
- 78207-86-0
|
| InChIKey |
UNBRKDKAWYKMIV-QWQRMKEZSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
Wikipedia
ChemSpider
|
| DOI |
|
| Downloads |
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|
| Elements |
H
C
O
N
|
| |
|
