| SpectraBase Compound ID | HOkPmraSSaW |
|---|---|
| InChI | InChI=1S/C48H54O13S/c1-3-62-47-45-43(60-48(51)61-45)41(38(57-47)31-53-27-34-18-10-5-11-19-34)59-46-44(58-39(50)25-24-32(2)49)42(55-29-36-22-14-7-15-23-36)40(54-28-35-20-12-6-13-21-35)37(56-46)30-52-26-33-16-8-4-9-17-33/h4-23,37-38,40-47H,3,24-31H2,1-2H3/t37-,38+,40+,41+,42+,43-,44-,45+,46+,47-/m1/s1 |
| InChIKey | SHCBOJBZYBSDEJ-LMSMHQDFSA-N |
| Mol Weight | 871.0 g/mol |
| Molecular Formula | C48H54O13S |
| Exact Mass | 870.328513 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ko71LeaLPYW |
|---|---|
| Name | ETHYL-6-O-BENZYL-2,3-O-CARBONATE-4-O-(3,4,6-TRI-O-BENZYL-2-O-LEVULINOYL-BETA-D-GALACTOPYRANOSYL)-1-THIO-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H54O13S |
| InChI | InChI=1S/C48H54O13S/c1-3-62-47-45-43(60-48(51)61-45)41(38(57-47)31-53-27-34-18-10-5-11-19-34)59-46-44(58-39(50)25-24-32(2)49)42(55-29-36-22-14-7-15-23-36)40(54-28-35-20-12-6-13-21-35)37(56-46)30-52-26-33-16-8-4-9-17-33/h4-23,37-38,40-47H,3,24-31H2,1-2H3/t37-,38+,40+,41+,42+,43-,44-,45+,46+,47-/m1/s1 |
| InChIKey | SHCBOJBZYBSDEJ-LMSMHQDFSA-N |
| Literature Reference Author | T.ZHU,G.J.BOONS |
| Literature Reference Citation | ORG.LETTERS,3,4201(2001) |
| Literature Reference DOI | 10.1021/ol016869j |
| Molecular Weight | 871.009 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU34005 |