![N-ACETYL-3-DEOXY-3-[N'-(3-AMINO-3-DEOXY-BETA-D-GLUCOPYRANOSYL)-THIOUREIDO]-BETA-D-GLUCOPYRANOSYLAMINE](/api/spectrum/EyIKJFefBs/structure.png?h=300&w=458 "N-ACETYL-3-DEOXY-3-[N'-(3-AMINO-3-DEOXY-BETA-D-GLUCOPYRANOSYL)-THIOUREIDO]-BETA-D-GLUCOPYRANOSYLAMINE")
| SpectraBase Compound ID | DIKJNSb1yoJ |
|---|---|
| InChI | InChI=1S/C15H28N4O9S/c1-4(22)17-14-12(26)8(10(24)6(3-21)28-14)18-15(29)19-13-11(25)7(16)9(23)5(2-20)27-13/h5-14,20-21,23-26H,2-3,16H2,1H3,(H,17,22)(H2,18,19,29)/t5-,6-,7+,8+,9-,10-,11-,12-,13-,14-/m1/s1 |
| InChIKey | ZZAHBXNIAYUXEO-FZMNTGFZSA-N |
| Mol Weight | 440.47 g/mol |
| Molecular Formula | C15H28N4O9S |
| Exact Mass | 440.1577 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EyIKJFefBs |
|---|---|
| Name | N-ACETYL-3-DEOXY-3-[N'-(3-AMINO-3-DEOXY-BETA-D-GLUCOPYRANOSYL)-THIOUREIDO]-BETA-D-GLUCOPYRANOSYLAMINE |
| Compound Number | 32 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C15H28N4O9S |
| InChI | InChI=1S/C15H28N4O9S/c1-4(22)17-14-12(26)8(10(24)6(3-21)28-14)18-15(29)19-13-11(25)7(16)9(23)5(2-20)27-13/h5-14,20-21,23-26H,2-3,16H2,1H3,(H,17,22)(H2,18,19,29)/t5-,6-,7+,8+,9-,10-,11-,12-,13-,14-/m1/s1 |
| InChIKey | ZZAHBXNIAYUXEO-FZMNTGFZSA-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 | 440.469 g/mol |
| Sample ID | 42789 |
| Solvent | D2O |