| SpectraBase Spectrum ID |
25a0AogPm9p |
| Name |
8.beta.-(3,5-Dioxopiperazin-1-ylmethyl)-1-ethyl-9,10-didehydro-6-methylergoline |
| Alternate Name(s) |
4-(((6aR,9S)-4-ethyl-7-methyl-4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinolin-9-yl)methyl)piperazine-2,6-dione
4-[[(6aR,9S)-4-ethyl-7-methyl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-yl]methyl]piperazine-2,6-dione |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H26N4O2 |
| InChI |
InChI=1S/C22H26N4O2/c1-3-26-11-15-8-19-17(16-5-4-6-18(26)22(15)16)7-14(9-24(19)2)10-25-12-20(27)23-21(28)13-25/h4-7,11,14,19H,3,8-10,12-13H2,1-2H3,(H,23,27,28)/t14-,19-/m1/s1 |
| InChIKey |
QIDRMWCDWSIHLP-AUUYWEPGSA-N |
| Molecular Weight |
378.476 g/mol |
| SMILES |
N1C(CN(CC1=O)C[C@@]1(C=C2c3c4c([n](CC)cc4C[C@]2(N(C)C1)[H])ccc3)[H])=O |
| SPLASH |
splash10-00dl-3292000000-e52132f74d042e4dc1f9 |
| Source of Spectrum |
EMC-34-117-3 |
| Wiley ID |
1734525 |
