SpectraBase Spectrum ID |
IwxrdeKL9gH |
Name |
[(2S,3R,5R,6S)-5-Benzoyloxy-3-hydroxy-6-(2-methoxy-2-oxo-ethyl)tetrahydropyran-2-yl]methyl benzoate |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
428.147117725 u |
Formula |
C23H24O8 |
InChI |
InChI=1S/C23H24O8/c1-28-21(25)13-19-18(31-23(27)16-10-6-3-7-11-16)12-17(24)20(30-19)14-29-22(26)15-8-4-2-5-9-15/h2-11,17-20,24H,12-14H2,1H3/t17-,18-,19+,20+/m1/s1 |
InChIKey |
CRNMBKJMOKLUAZ-ZRNYENFQSA-N |
Molecular Weight |
428.437 g/mol |
SMILES |
[C@@]1(O[C@]([C@@](C[C@]1(OC(=O)C=1C=CC=CC1)[H])(O)[H])(COC(=O)C1=CC=CC=C1)[H])(CC(=O)OC)[H] |