| SpectraBase Compound ID | 29expV3QxSN |
|---|---|
| InChI | InChI=1S/C40H48N2O12/c1-24(43)41-32-36(48-21-28-16-10-6-11-17-28)34-31(23-49-38(53-34)29-18-12-7-13-19-29)52-40(32)54-35-30(22-47-20-27-14-8-5-9-15-27)51-39(46-4)33(42-25(2)44)37(35)50-26(3)45/h5-19,30-40H,20-23H2,1-4H3,(H,41,43)(H,42,44)/t30-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40+/m1/s1 |
| InChIKey | KRAKUXYHRGXKDO-DYLIADBVSA-N |
| Mol Weight | 748.8 g/mol |
| Molecular Formula | C40H48N2O12 |
| Exact Mass | 748.320725 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CizvAa61bHe |
|---|---|
| Name | #26;METHYL-2-ACETAMIDO-3-O-BENZYL-4,6-O-BENZYLIDENE-2-DEOXY-BETA-D-GLUCOPYRANOSYL-(1->4)-2-ACETAMIDO-3-O-ACETYL-6-O-BENZYL-2-DEOXY-BETA-D-GLUCOPYRANOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H48N2O12 |
| InChI | InChI=1S/C40H48N2O12/c1-24(43)41-32-36(48-21-28-16-10-6-11-17-28)34-31(23-49-38(53-34)29-18-12-7-13-19-29)52-40(32)54-35-30(22-47-20-27-14-8-5-9-15-27)51-39(46-4)33(42-25(2)44)37(35)50-26(3)45/h5-19,30-40H,20-23H2,1-4H3,(H,41,43)(H,42,44)/t30-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40+/m1/s1 |
| InChIKey | KRAKUXYHRGXKDO-DYLIADBVSA-N |
| Literature Reference Author | D.HESEK,M.SUVOROV,K.MORIO,M.LEE,S.BROWN,S.B.VAKULENKO,S.MOBA SHERY |
| Literature Reference Citation | J.ORG.CHEM.,69,778(2004) |
| Literature Reference DOI | 10.1021/jo035397e |
| Molecular Weight | 748.827 g/mol |
| Solvent | CD3OD:CDCl3=5:95 |
| Source File Reference | UWVN21549 |