SpectraBase Compound ID | 7WU2uUKsTA4 |
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InChI | InChI=1S/C37H40O7S/c1-2-45-37-35(43-25-30-20-12-13-21-31(30)36(38)39)34(42-24-29-18-10-5-11-19-29)33(41-23-28-16-8-4-9-17-28)32(44-37)26-40-22-27-14-6-3-7-15-27/h3-21,32-35,37H,2,22-26H2,1H3,(H,38,39)/t32-,33-,34+,35-,37-/m1/s1 |
InChIKey | MSGADLTZRINJRP-DUSCDBLMSA-N |
Mol Weight | 628.8 g/mol |
Molecular Formula | C37H40O7S |
Exact Mass | 628.249475 g/mol |
SpectraBase Spectrum ID | GJgSD7xCIEY |
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Name | ETHYL-3,4,6-TRI-O-BENZYL-2-O-(2-CARBOXYBENZYL)-1-THIO-ALPHA-D-GLUCOPYRANOSIDE |
Compound Number | 3B |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C37H40O7S |
InChI | InChI=1S/C37H40O7S/c1-2-45-37-35(43-25-30-20-12-13-21-31(30)36(38)39)34(42-24-29-18-10-5-11-19-29)33(41-23-28-16-8-4-9-17-28)32(44-37)26-40-22-27-14-6-3-7-15-27/h3-21,32-35,37H,2,22-26H2,1H3,(H,38,39)/t32-,33-,34+,35-,37-/m1/s1 |
InChIKey | MSGADLTZRINJRP-DUSCDBLMSA-N |
Literature Reference Author | G.LEMANSKI,T.ZIEGLER |
Literature Reference Citation | EUR.J.ORG.CHEM.,2618(2006) |
Molecular Weight | 628.780 g/mol |
Sample ID | 43702 |
Solvent | CDCl3 |