| SpectraBase Spectrum ID |
JdW7XOa0T4V |
| Name |
8.beta.-(3,5-Dioxopiperazin-1-ylethyl)-9,10-didehydro-6-methylergoline |
| Alternate Name(s) |
4-(2-((6aR,9R)-7-methyl-4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinolin-9-yl)ethyl)piperazine-2,6-dione
4-[2-[(6aR,9R)-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-yl]ethyl]piperazine-2,6-dione |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H24N4O2 |
| InChI |
InChI=1S/C21H24N4O2/c1-24-10-13(5-6-25-11-19(26)23-20(27)12-25)7-16-15-3-2-4-17-21(15)14(9-22-17)8-18(16)24/h2-4,7,9,13,18,22H,5-6,8,10-12H2,1H3,(H,23,26,27)/t13-,18-/m1/s1 |
| InChIKey |
NCPJYDOIIFXDIY-FZKQIMNGSA-N |
| Molecular Weight |
364.449 g/mol |
| SMILES |
N1C(CN(CC[C@@]2(C=C3[C@@](Cc4c5c([nH]c4)cccc35)(N(C2)C)[H])[H])CC1=O)=O |
| SPLASH |
splash10-0006-5943000000-1686fa33e0db36ad53b2 |
| Source of Spectrum |
EMC-34-119-14 |
| Wiley ID |
1734515 |
