![#22;METHYL-6-DEOXY-6-[N'-[6-DEOXY-6-[N'-(2,3,4-TRI-O-ACETYL-6-AZIDO-6-DEOXY-BETA-D-GLUCOPYRANOSYL)-THIOUREIDO]-6-DEOXY-BETA-D-GLUCOPYRANOSYL]-THIOUREIDO](/api/spectrum/10prAgvLIPj/structure.png?h=300&w=458 "#22;METHYL-6-DEOXY-6-[N'-[6-DEOXY-6-[N'-(2,3,4-TRI-O-ACETYL-6-AZIDO-6-DEOXY-BETA-D-GLUCOPYRANOSYL)-THIOUREIDO]-6-DEOXY-BETA-D-GLUCOPYRANOSYL]-THIOUREIDO")
| SpectraBase Compound ID | H7XcjGJ46o2 |
|---|---|
| InChI | InChI=1S/C27H43N7O16S2/c1-8(35)45-20-13(7-31-34-28)49-24(22(47-10(3)37)21(20)46-9(2)36)33-27(52)29-5-11-14(38)16(40)18(42)23(48-11)32-26(51)30-6-12-15(39)17(41)19(43)25(44-4)50-12/h11-25,38-43H,5-7H2,1-4H3,(H2,29,33,52)(H2,30,32,51)/t11-,12-,13+,14-,15-,16+,17+,18-,19-,20+,21-,22+,23-,24+,25+/m0/s1 |
| InChIKey | PPNLDPFDBQUGGK-UQSSYHGDSA-N |
| Mol Weight | 785.8 g/mol |
| Molecular Formula | C27H43N7O16S2 |
| Exact Mass | 785.220771 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 10prAgvLIPj |
|---|---|
| Name | #22;METHYL-6-DEOXY-6-[N'-[6-DEOXY-6-[N'-(2,3,4-TRI-O-ACETYL-6-AZIDO-6-DEOXY-BETA-D-GLUCOPYRANOSYL)-THIOUREIDO]-6-DEOXY-BETA-D-GLUCOPYRANOSYL]-THIOUREIDO |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H43N7O16S2 |
| InChI | InChI=1S/C27H43N7O16S2/c1-8(35)45-20-13(7-31-34-28)49-24(22(47-10(3)37)21(20)46-9(2)36)33-27(52)29-5-11-14(38)16(40)18(42)23(48-11)32-26(51)30-6-12-15(39)17(41)19(43)25(44-4)50-12/h11-25,38-43H,5-7H2,1-4H3,(H2,29,33,52)(H2,30,32,51)/t11-,12-,13+,14-,15-,16+,17+,18-,19-,20+,21-,22+,23-,24+,25+/m0/s1 |
| InChIKey | PPNLDPFDBQUGGK-UQSSYHGDSA-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 | 785.796 g/mol |
| Sample ID | 42779 |
| Solvent | D2O |