SpectraBase Spectrum ID |
1SsMVm2Ga7L |
Name |
.alpha.-D-Xylofuranose, 3-C-[(carboxyoxy)methyl]-, intramol. 3,3-ester, 1,2-diacetate 5-benzoate |
Alternate Name(s) |
1,3,7-Trioxaspiro[4.4]nonane, .alpha.-D-xylofuranose deriv.
1,2-Di-O-acetyl-5-O-benzoyl-3,3(1)-carbonyl-3-hydroxymethyl-.alpha.- and -.beta.-D-xylofuranose
[(5S,6R,8R,9R)-8,9-bis(acetyloxy)-2-oxo-1,3,7-trioxaspiro[4.4]non-6-yl]methyl benzoate |
CAS Registry Number |
70723-13-6 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H18O10 |
InChI |
InChI=1S/C18H18O10/c1-10(19)25-14-16(26-11(2)20)27-13(18(14)9-24-17(22)28-18)8-23-15(21)12-6-4-3-5-7-12/h3-7,13-14,16H,8-9H2,1-2H3/t13-,14+,16+,18+/m1/s1 |
InChIKey |
RHRSFXITJAYNCY-OAOQPFQOSA-N |
Molecular Weight |
394.332 g/mol |
SMILES |
[C@]12([C@]([C@@](OC(=O)C)(O[C@@]2(COC(=O)c2ccccc2)[H])[H])(OC(=O)C)[H])OC(=O)OC1 |
SPLASH |
splash10-0a4i-0950000000-2cba349fb274581e31c7 |
Source of Spectrum |
H-62-693-0 |
Wiley ID |
1366503 |