![N-ACETYL-3,6-DIDEOXY-3,6-BIS-[N'-(2,4-DI-O-ACETYL-3,6-DIAZIDO-3,6-DIDEOXY-BETA-D-GLUCOPYRANOSYL)-THIOUREIDO]-BETA-D-GLUCOPYRANOSYLAMINE](/api/spectrum/9N0G1mOSK26/structure.png?h=300&w=458 "N-ACETYL-3,6-DIDEOXY-3,6-BIS-[N'-(2,4-DI-O-ACETYL-3,6-DIAZIDO-3,6-DIDEOXY-BETA-D-GLUCOPYRANOSYL)-THIOUREIDO]-BETA-D-GLUCOPYRANOSYLAMINE")
| SpectraBase Compound ID | DeXtyAGlD6G |
|---|---|
| InChI | InChI=1S/C30H43N17O14S2/c1-9(48)38-26-21(54)17(39-30(63)41-28-25(58-13(5)52)19(43-47-34)23(56-11(3)50)16(61-28)8-37-45-32)20(53)14(59-26)6-35-29(62)40-27-24(57-12(4)51)18(42-46-33)22(55-10(2)49)15(60-27)7-36-44-31/h14-28,53-54H,6-8H2,1-5H3,(H,38,48)(H2,35,40,62)(H2,39,41,63)/t14-,15+,16-,17+,18-,19+,20-,21-,22+,23-,24+,25-,26-,27+,28-/m0/s1 |
| InChIKey | JIHJCJWSHXADJS-LZEHPNFASA-N |
| Mol Weight | 929.9 g/mol |
| Molecular Formula | C30H43N17O14S2 |
| Exact Mass | 929.261681 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9N0G1mOSK26 |
|---|---|
| Name | N-ACETYL-3,6-DIDEOXY-3,6-BIS-[N'-(2,4-DI-O-ACETYL-3,6-DIAZIDO-3,6-DIDEOXY-BETA-D-GLUCOPYRANOSYL)-THIOUREIDO]-BETA-D-GLUCOPYRANOSYLAMINE |
| Compound Number | 41 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H43N17O14S2 |
| InChI | InChI=1S/C30H43N17O14S2/c1-9(48)38-26-21(54)17(39-30(63)41-28-25(58-13(5)52)19(43-47-34)23(56-11(3)50)16(61-28)8-37-45-32)20(53)14(59-26)6-35-29(62)40-27-24(57-12(4)51)18(42-46-33)22(55-10(2)49)15(60-27)7-36-44-31/h14-28,53-54H,6-8H2,1-5H3,(H,38,48)(H2,35,40,62)(H2,39,41,63)/t14-,15+,16-,17+,18-,19+,20-,21-,22+,23-,24+,25-,26-,27+,28-/m0/s1 |
| InChIKey | JIHJCJWSHXADJS-LZEHPNFASA-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 | 929.897 g/mol |
| Sample ID | 42798 |
| Solvent | CD3OD |