| SpectraBase Spectrum ID |
LbRFvtlxr5a |
| Name |
D-Glucitol, 2-(acetylmethylamino)-6-o-[2-(acetylmethylamino)-2-deoxy-3,4,6-tri-o- methyl-.alpha.-D-glucopyranosyl]-2-deoxy-1,3,4,5-tetra-o-methyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
552.325810363 u |
| Formula |
C25H48N2O11 |
| InChI |
InChI=1S/C25H48N2O11/c1-15(28)26(3)17(12-30-5)21(33-8)22(34-9)18(32-7)14-37-25-20(27(4)16(2)29)24(36-11)23(35-10)19(38-25)13-31-6/h17-25H,12-14H2,1-11H3 |
| InChIKey |
CLRKDWQZXPRMCW-UHFFFAOYSA-N |
| Molecular Weight |
552.662 g/mol |
| SMILES |
C1(C(C(OC)C(OC1OCC(C(C(C(N(C(=O)C)C)COC)OC)OC)OC)COC)OC)N(C(=O)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.903463 |
![D-Glucitol, 2-(acetylmethylamino)-6-o-[2-(acetylmethylamino)-2-deoxy-3,4,6-tri-o- methyl-.alpha.-D-glucopyranosyl]-2-deoxy-1,3,4,5-tetra-o-methyl-](/api/spectrum/LbRFvtlxr5a/structure.png?h=300&w=458 "D-Glucitol, 2-(acetylmethylamino)-6-o-[2-(acetylmethylamino)-2-deoxy-3,4,6-tri-o- methyl-.alpha.-D-glucopyranosyl]-2-deoxy-1,3,4,5-tetra-o-methyl-")
