| SpectraBase Compound ID | BKJQxNfwzC1 |
|---|---|
| InChI | InChI=1S/C34H58N4O22/c1-53-16(42)8-6-4-2-3-5-7-9-54-32-17(36-30(52)29-23(48)22(47)24(49)31(58-29)37-38-35)20(45)27(15(12-41)57-32)59-34-26(51)28(19(44)14(11-40)56-34)60-33-25(50)21(46)18(43)13(10-39)55-33/h13-15,17-29,31-34,39-41,43-51H,2-12H2,1H3,(H,36,52)/t13-,14-,15-,17-,18+,19+,20-,21+,22-,23-,24+,25-,26-,27-,28+,29-,31+,32-,33-,34+/m1/s1 |
| InChIKey | UZTHVSBBIOQYQI-BRSGJSDQSA-N |
| Mol Weight | 874.8 g/mol |
| Molecular Formula | C34H58N4O22 |
| Exact Mass | 874.35427 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EsBESnviU3B |
|---|---|
| Name | #8F;8-METHOXYCARBONYLOCTYL-ALPHA-D-GALACTOPYRANOSYL-(1->3)-BETA-D-GALACTOPYRANOSYL-(1->4)-2-DEOXY-2-(1-DEOXY-1-AZIDO-BETA-D-GLUCOHEXOPYRANOSYLURONAMIDE)-BETA-D |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H58N4O22 |
| InChI | InChI=1S/C34H58N4O22/c1-53-16(42)8-6-4-2-3-5-7-9-54-32-17(36-30(52)29-23(48)22(47)24(49)31(58-29)37-38-35)20(45)27(15(12-41)57-32)59-34-26(51)28(19(44)14(11-40)56-34)60-33-25(50)21(46)18(43)13(10-39)55-33/h13-15,17-29,31-34,39-41,43-51H,2-12H2,1H3,(H,36,52)/t13-,14-,15-,17-,18+,19+,20-,21+,22-,23-,24+,25-,26-,27-,28+,29-,31+,32-,33-,34+/m1/s1 |
| InChIKey | UZTHVSBBIOQYQI-BRSGJSDQSA-N |
| Literature Reference Author | O.SCHWARDT,G.BAISCH,R.OEHRLEIN |
| Literature Reference Citation | BIOORG.MED.CHEM.,9,1857(2001) |
| Literature Reference DOI | 10.1016/S0968-0896(01)00086-4 |
| Molecular Weight | 874.848 g/mol |
| Solvent | D2O |
| Source File Reference | UWMS22012 |