| SpectraBase Spectrum ID |
EQ3CWBHUMcT |
| Name |
(3S/R,8R,9S)-3-Hydroxy-3-(3"-hydroxy-1"-propynyl)-6'-methoxyruban-9-ol |
| Alternate Name(s) |
(3S/R,8R,9S)-3-Hydroxy-3-(3''-hydroxy-1''-propynyl)-6'-methoxyruban-9-ol
6-[(S)-Hydroxy-(6-methoxy-quinolin-4-yl)-methyl]-3-(3-hydroxy-prop-1-ynyl)-1-aza-bicyclo[2.2.2]octan-3-ol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H24N2O4 |
| InChI |
InChI=1S/C21H24N2O4/c1-27-15-3-4-18-17(12-15)16(5-8-22-18)20(25)19-11-14-6-9-23(19)13-21(14,26)7-2-10-24/h3-5,8,12,14,19-20,24-26H,6,9-11,13H2,1H3/t14-,19+,20+,21-/m1/s1 |
| InChIKey |
CFEITNKOYNVWRO-AKQDLLBKSA-N |
| Molecular Weight |
368.433 g/mol |
| SMILES |
O[C@]([C@]1(N2C[C@@]([C@@](C1)(CC2)[H])(C#CCO)O)[H])(c1c2c(ncc1)ccc(c2)OC)[H] |
| SPLASH |
splash10-0hh0-0393000000-c88a6271ee48ffa6fb95 |
| Source of Spectrum |
F-53-9152-2 |
| Wiley ID |
802737 |
