| SpectraBase Compound ID | DLAOMnBMRfi |
|---|---|
| InChI | InChI=1S/C17H33NO11S/c18-2-5-30-4-1-3-26-17-15(13(24)11(22)9(7-20)28-17)29-16-14(25)12(23)10(21)8(6-19)27-16/h8-17,19-25H,1-7,18H2/t8-,9-,10-,11-,12+,13+,14+,15+,16+,17-/m1/s1 |
| InChIKey | TZYCTSKZFNQPLJ-LZXKHOKXSA-N |
| Mol Weight | 459.5 g/mol |
| Molecular Formula | C17H33NO11S |
| Exact Mass | 459.177432 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 54yzbWOn6yf |
|---|---|
| Name | 3-(2-AMINOETHYLTHIO)-PROPYL-BETA-D-MANNOPYRANOSYL-(1->2)-BETA-D-MANNOPYRANOSIDE |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C17H33NO11S |
| InChI | InChI=1S/C17H33NO11S/c18-2-5-30-4-1-3-26-17-15(13(24)11(22)9(7-20)28-17)29-16-14(25)12(23)10(21)8(6-19)27-16/h8-17,19-25H,1-7,18H2/t8-,9-,10-,11-,12+,13+,14+,15+,16+,17-/m1/s1 |
| InChIKey | TZYCTSKZFNQPLJ-LZXKHOKXSA-N |
| Literature Reference Author | M.NITZ,D.R.BUNDLE |
| Literature Reference Citation | J.ORG.CHEM.,66,8411(2001) |
| Literature Reference DOI | 10.1021/jo010570x |
| Molecular Weight | 459.509 g/mol |
| Solvent | D2O |
| Source File Reference | UWLU29149 |