| SpectraBase Spectrum ID |
CnnQ6Weve5c |
| Name |
[8.beta.-(3,5-dioxo-4-methylpiperazin-1-yl)-methyl]-9,10-didehydro-6-methylergoline |
| Alternate Name(s) |
1-Methyl-4-(((9S)-7-methyl-4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinolin-9-yl)methyl)piperazine-2,6-dione |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H24N4O2 |
| InChI |
InChI=1S/C21H24N4O2/c1-23-9-13(10-25-11-19(26)24(2)20(27)12-25)6-16-15-4-3-5-17-21(15)14(8-22-17)7-18(16)23/h3-6,8,13,18,22H,7,9-12H2,1-2H3/t13-,18?/m1/s1 |
| InChIKey |
KNSZZNGUCDKLJG-YJJYDOSJSA-N |
| Molecular Weight |
364.449 g/mol |
| SMILES |
[nH]1cc2CC3C(c4c2c1ccc4)=C[C@](CN3C)(CN1CC(=O)N(C(C1)=O)C)[H] |
| SPLASH |
splash10-01vo-2972000000-cf8bbe6d27b92bcb7e1f |
| Source of Spectrum |
EMC-34-119-15 |
| Wiley ID |
1734514 |
![[8.beta.-(3,5-dioxo-4-methylpiperazin-1-yl)-methyl]-9,10-didehydro-6-methylergoline](/api/spectrum/CnnQ6Weve5c/structure.png?h=300&w=458 "[8.beta.-(3,5-dioxo-4-methylpiperazin-1-yl)-methyl]-9,10-didehydro-6-methylergoline")
