| SpectraBase Spectrum ID |
1UaK9oGG4py |
| Name |
Ergoline-6-carbonitrile, 8-[[[(4-methylphenyl)sulfonyl]oxy]methyl]-, (8.beta.)- |
| Alternate Name(s) |
Indolo[4,3-fg]quinoline, ergoline-6-carbonitrile deriv.
(5R,8R,10R)-8-[(tosyloxy)methyl]ergoline-6-carbonitrile
[(8beta)-6-cyanoergolin-8-yl]methyl 4-methylbenzenesulfonate
[(6aR,9R,10aR)-7-cyano-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-yl]methyl 4-methylbenzenesulfonate |
| CAS Registry Number |
98988-33-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H23N3O3S |
| InChI |
InChI=1S/C23H23N3O3S/c1-15-5-7-18(8-6-15)30(27,28)29-13-16-9-20-19-3-2-4-21-23(19)17(11-25-21)10-22(20)26(12-16)14-24/h2-8,11,16,20,22,25H,9-10,12-13H2,1H3/t16-,20-,22-/m1/s1 |
| InChIKey |
PRPFIPYDPSERTF-BSLALVQMSA-N |
| Molecular Weight |
421.515 g/mol |
| SMILES |
[nH]1cc2c3c1cccc3[C@@]1([C@@](C2)(N(C[C@@](C1)(COS(c1ccc(cc1)C)(=O)=O)[H])C#N)[H])[H] |
| SPLASH |
splash10-00dr-0050900000-c4d9b392d60d60358cd8 |
| Source of Spectrum |
H-68-1031-3 |
| Wiley ID |
1378313 |
![Ergoline-6-carbonitrile, 8-[[[(4-methylphenyl)sulfonyl]oxy]methyl]-, (8.beta.)-](/api/spectrum/1UaK9oGG4py/structure.png?h=300&w=458 "Ergoline-6-carbonitrile, 8-[[[(4-methylphenyl)sulfonyl]oxy]methyl]-, (8.beta.)-")
