| SpectraBase Spectrum ID |
9z7xVLKhU |
| Name |
(5R,8R)-5(10-9)-abeo-6-propyl-8.beta.-chloromethyl-9,10-didehydroergoline |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H21ClN2 |
| InChI |
InChI=1S/C18H21ClN2/c1-2-6-21-11-14(9-19)15-7-12-4-3-5-16-18(12)13(10-20-16)8-17(15)21/h3-5,7,10,14,17,20H,2,6,8-9,11H2,1H3/t14-,17+/m0/s1 |
| InChIKey |
AHMDSFBTPITWMU-WMLDXEAASA-N |
| Molecular Weight |
300.833 g/mol |
| SMILES |
[nH]1c2c3c(C=C4[C@@](Cc3c1)(N(C[C@@]4(CCl)[H])CCC)[H])ccc2 |
| SPLASH |
splash10-0uxr-0974000000-761af888dcca54d48e1d |
| Source of Spectrum |
EMC-33-289-f |
| Synonyms |
(5R,8R)-5(10-9)-abeo-6-propyl-8.beta.-chloromethyl-9,10-didehydroergooline
(7R,9aR)-7-(chloromethyl)-9-propyl-2,7,8,9,9a,10-hexahydropyrrolo[3',2':5,6]cyclohepta[1,2,3-cd]indole |
| Wiley ID |
1734455 |
