| SpectraBase Compound ID | KCr1yl37HSl |
|---|---|
| InChI | InChI=1S/C39H55ClFNO15/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 | PXYDIEMHRFQMHV-COFPWFGNSA-N |
| Mol Weight | 832.3 g/mol |
| Molecular Formula | C39H55ClFNO15 |
| Exact Mass | 831.324426 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 | IcfbmkNilOf |
|---|---|
| Name | #22;METHYL-2-ACETAMIDO-6-O-BENZOYL-3-O-CHLOROACETYL-2-DEOXY-4-O-(4-DEOXY-4-FLUORO-2,3,6-TRI-O-PIVALOYL-BETA-D-GALACTOPYRANOSYL)-BETA-D-GLUCOPYRANOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H55ClFNO15 |
| InChI | InChI=1S/C39H55ClFNO15/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 | PXYDIEMHRFQMHV-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 | 832.315 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWIR10937 |