| SpectraBase Spectrum ID |
C9qD27860Z8 |
| Name |
D-Glucopyranosylamine, N-(4-methylphenyl)-6-o-(2,3,4,6-tetra-o-acetyl-.alpha.-D-galactopyranosyl)-, 2,3,4-triacetate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
725.253098912 u |
| Formula |
C33H43NO17 |
| InChI |
InChI=1S/C33H43NO17/c1-15-9-11-23(12-10-15)34-32-30(48-21(7)40)28(46-19(5)38)26(44-17(3)36)24(50-32)14-43-33-31(49-22(8)41)29(47-20(6)39)27(45-18(4)37)25(51-33)13-42-16(2)35/h9-12,24-34H,13-14H2,1-8H3 |
| InChIKey |
ASCUXPQGEXGEMJ-UHFFFAOYSA-N |
| Molecular Weight |
725.697 g/mol |
| SMILES |
CC1=CC=C(C=C1)NC1C(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(COC2[C@@]([C@]([C@](OC(=O)C)([C@](O2)(COC(=O)C)[H])[H])(OC(C)=O)[H])(OC(C)=O)[H])O1 |
