![METHYL-6-DEOXY-6-[N'-(6-AMINO-6-DEOXY-BETA-D-GLUCOPYRANOSYL)-THIOUREIDO]-ALPHA-D-GLUCOPYRANOSIDE](/api/spectrum/CTeC5vpIYIE/structure.png?h=300&w=458 "METHYL-6-DEOXY-6-[N'-(6-AMINO-6-DEOXY-BETA-D-GLUCOPYRANOSYL)-THIOUREIDO]-ALPHA-D-GLUCOPYRANOSIDE")
| SpectraBase Compound ID | DMFNX63AK5U |
|---|---|
| InChI | InChI=1S/C14H27N3O9S/c1-24-13-11(23)9(21)7(19)5(26-13)3-16-14(27)17-12-10(22)8(20)6(18)4(2-15)25-12/h4-13,18-23H,2-3,15H2,1H3,(H2,16,17,27)/t4-,5+,6-,7+,8+,9-,10-,11+,12-,13-/m0/s1 |
| InChIKey | LPFSWEWBALLBSC-BKJHLMOPSA-N |
| Mol Weight | 413.44 g/mol |
| Molecular Formula | C14H27N3O9S |
| Exact Mass | 413.146801 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CTeC5vpIYIE |
|---|---|
| Name | METHYL-6-DEOXY-6-[N'-(6-AMINO-6-DEOXY-BETA-D-GLUCOPYRANOSYL)-THIOUREIDO]-ALPHA-D-GLUCOPYRANOSIDE |
| Compound Number | 21 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C14H27N3O9S |
| InChI | InChI=1S/C14H27N3O9S/c1-24-13-11(23)9(21)7(19)5(26-13)3-16-14(27)17-12-10(22)8(20)6(18)4(2-15)25-12/h4-13,18-23H,2-3,15H2,1H3,(H2,16,17,27)/t4-,5+,6-,7+,8+,9-,10-,11+,12-,13-/m0/s1 |
| InChIKey | LPFSWEWBALLBSC-BKJHLMOPSA-N |
| Literature Reference Author | J.L.J.BLANCO,P.BOOTELLO,C.O.MELLET,J.M.G.FERNANDEZ |
| Literature Reference Citation | EUR.J.ORG.CHEM.,183(2006) |
| Molecular Weight | 413.443 g/mol |
| Sample ID | 42778 |
| Solvent | D2O |