| SpectraBase Spectrum ID |
EDctcbn50qk |
| Name |
Methyl 6-o-ditolyl(2-pyridyl)methyl .alpha.,D-glucopyranoside |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
465.215137716 u |
| Formula |
C27H31NO6 |
| InChI |
InChI=1S/C27H31NO6/c1-17-7-11-19(12-8-17)27(22-6-4-5-15-28-22,20-13-9-18(2)10-14-20)33-16-21-23(29)24(30)25(31)26(32-3)34-21/h4-15,21,23-26,29-31H,16H2,1-3H3/t21-,23-,24+,25-,26+/m1/s1 |
| InChIKey |
CMYVWESPERWFDL-ZGLCYIBRSA-N |
| Molecular Weight |
465.546 g/mol |
| SMILES |
[C@@]1([C@]([C@](O)([C@](O[C@@]1(OC)[H])(COC(C1=CC=C(C=C1)C)(C=1C=CC(=CC1)C)C1=NC=CC=C1)[H])[H])(O)[H])(O)[H] |
