| SpectraBase Spectrum ID |
7EV3ZHen1Qb |
| Name |
6-Methyl-8.beta.-phenylsulfonylaminomethyl-13-tert-butyl-ergoline |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H33N3O2S |
| InChI |
InChI=1S/C26H33N3O2S/c1-26(2,3)19-12-22-21-10-17(14-28-32(30,31)20-8-6-5-7-9-20)16-29(4)24(21)11-18-15-27-23(13-19)25(18)22/h5-9,12-13,15,17,21,24,27-28H,10-11,14,16H2,1-4H3/t17-,21+,24+/m0/s1 |
| InChIKey |
OJZCSOTVTRJAPN-XVWGUNQUSA-N |
| Molecular Weight |
451.629 g/mol |
| SMILES |
N(S(=O)(=O)c1ccccc1)C[C@@]1(C[C@@]2(c3c4c(cc(c3)C(C)(C)C)[nH]cc4C[C@]2(N(C1)C)[H])[H])[H] |
| SPLASH |
splash10-0ufr-9250600000-5696a6c7796269fd38dc |
| Source of Spectrum |
EMC-32-803-31 |
| Synonyms |
N-(((6aR,9R,10aR)-2-(tert-butyl)-7-methyl-4,6,6a,7,8,9,10,10a-octahydroindolo[4,3-fg]quinolin-9-yl)methyl)benzenesulfonamide |
| Wiley ID |
1734371 |
