| SpectraBase Compound ID | GAQS4urKFox |
|---|---|
| InChI | InChI=1S/2C48H58O12/c2*1-47(2,3)46(50)59-42-41(39(57-44(42)49)37-31-55-48(4,5)60-37)58-45-43(54-29-35-24-16-9-17-25-35)40(53-28-34-22-14-8-15-23-34)38(52-27-33-20-12-7-13-21-33)36(56-45)30-51-26-32-18-10-6-11-19-32/h2*6-25,36-45,49H,26-31H2,1-5H3/t36-,37?,38+,39+,40+,41+,42-,43-,44-,45-;36-,37?,38+,39-,40+,41-,42+,43-,44-,45-/m10/s1 |
| InChIKey | IDTJGSVMHNSHDW-VNAIAYEVSA-N |
| Mol Weight | 1654.0 g/mol |
| Molecular Formula | C96H116O24 |
| Exact Mass | 1652.785655 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8CqfgzHiWN9 |
|---|---|
| Name | 2,3,4,6-TETRA-O-BENZYL-ALPHA-D-GALACTOPYRANOSYL-(1->3)-5,6-O-ISOPROPYLIDENE-2-O-PIVALOYL-D-GALACTOFURANOSE |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C96H116O24 |
| InChI | InChI=1S/2C48H58O12/c2*1-47(2,3)46(50)59-42-41(39(57-44(42)49)37-31-55-48(4,5)60-37)58-45-43(54-29-35-24-16-9-17-25-35)40(53-28-34-22-14-8-15-23-34)38(52-27-33-20-12-7-13-21-33)36(56-45)30-51-26-32-18-10-6-11-19-32/h2*6-25,36-45,49H,26-31H2,1-5H3/t36-,37?,38+,39+,40+,41+,42-,43-,44-,45-;36-,37?,38+,39-,40+,41-,42+,43-,44-,45-/m10/s1 |
| InChIKey | IDTJGSVMHNSHDW-VNAIAYEVSA-N |
| Literature Reference Author | L.GANDOLFI-DONADIO,C.GALLO-RODRIGUEZ,R.M.D.LEDERKREMER |
| Literature Reference Citation | J.ORG.CHEM.,67,4430(2002) |
| Literature Reference DOI | 10.1021/jo016290z |
| Molecular Weight | 1653.963 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN23220 |