| SpectraBase Spectrum ID |
9K7KEH1jZFh |
| Name |
o-(2-Acetamido-2-deoxy-3,4,6-tri-o-benzoyl-alpha-D-glucopyranosyl)-o,o-dipivaloylphosphite |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
765.255027466 u |
| Formula |
C39H44NO13P |
| InChI |
InChI=1S/C39H44NO13P/c1-24(41)40-29-31(50-34(44)27-21-15-10-16-22-27)30(49-33(43)26-19-13-9-14-20-26)28(23-47-32(42)25-17-11-8-12-18-25)48-35(29)51-54(52-36(45)38(2,3)4)53-37(46)39(5,6)7/h8-22,28-31,35H,23H2,1-7H3,(H,40,41)/t28-,29-,30-,31-,35-/m1/s1 |
| InChIKey |
SRUCTZDNHFHCOK-LRTRANQPSA-N |
| Molecular Weight |
765.749 g/mol |
| SMILES |
N([C@]1([C@](O[C@@]([C@]([C@@]1(OC(c1ccccc1)=O)[H])(OC(c1ccccc1)=O)[H])(COC(c1ccccc1)=O)[H])(OP(OC(=O)C(C)(C)C)OC(=O)C(C)(C)C)[H])[H])C(C)=O |
