| SpectraBase Compound ID | 7JJ9iosiSvn |
|---|---|
| InChI | InChI=1S/C39H55Cl2NO15/c1-20(43)42-26-29(54-24(44)17-40)27(23(53-32(26)49-11)19-50-31(45)21-15-13-12-14-16-21)55-33-30(57-36(48)39(8,9)10)28(56-35(47)38(5,6)7)25(41)22(52-33)18-51-34(46)37(2,3)4/h12-16,22-23,25-30,32-33H,17-19H2,1-11H3,(H,42,43)/t22-,23-,25+,26-,27-,28+,29-,30-,32-,33+/m1/s1 |
| InChIKey | YXZRWYFEHVORIO-COFPWFGNSA-N |
| Mol Weight | 848.8 g/mol |
| Molecular Formula | C39H55Cl2NO15 |
| Exact Mass | 847.294875 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F2TveYBKqnQ |
|---|---|
| Name | #21;METHYL-2-ACETAMIDO-6-O-BENZOYL-3-O-CHLOROACETYL-4-O-(4-CHLORO-4-DEOXY-2,3,6-TRI-O-PIVALOYL-BETA-D-GALACTOPYRANOSYL)-2-DEOXY-BETA-D-GLUCOPYRANOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H55Cl2NO15 |
| InChI | InChI=1S/C39H55Cl2NO15/c1-20(43)42-26-29(54-24(44)17-40)27(23(53-32(26)49-11)19-50-31(45)21-15-13-12-14-16-21)55-33-30(57-36(48)39(8,9)10)28(56-35(47)38(5,6)7)25(41)22(52-33)18-51-34(46)37(2,3)4/h12-16,22-23,25-30,32-33H,17-19H2,1-11H3,(H,42,43)/t22-,23-,25+,26-,27-,28+,29-,30-,32-,33+/m1/s1 |
| InChIKey | YXZRWYFEHVORIO-COFPWFGNSA-N |
| Literature Reference Author | C.J.MOORE,F.I.AUZANNEAU |
| Literature Reference Citation | BEIL.J.ORG.CHEM.,8,1134(2012) |
| Literature Reference DOI | 10.3762/bjoc.8.126 |
| Molecular Weight | 848.769 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWIR10936 |