| SpectraBase Compound ID | LpG7z87a6j4 |
|---|---|
| InChI | InChI=1S/C36H42O15S/c1-6-52-35-31(46-32(40)22-13-9-7-10-14-22)29(27-25(45-35)18-42-33(47-27)23-15-11-8-12-16-23)49-36(5)50-30-28(44-21(4)39)26(48-34(30)51-36)24(43-20(3)38)17-41-19(2)37/h7-16,24-31,33-35H,6,17-18H2,1-5H3/t24?,25-,26+,27-,28+,29+,30-,31+,33-,34-,35-,36+/m1/s1 |
| InChIKey | BDUHKDVAECBTTO-CAYWZKGLSA-N |
| Mol Weight | 746.8 g/mol |
| Molecular Formula | C36H42O15S |
| Exact Mass | 746.224442 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 14vzZCrUNDB |
|---|---|
| Name | 3,5,6-TRI-O-ACETYL-1,2-(ETHYL_2-O-BENZOYL-4,6-O-BENZYLIDENE-1-THIO-ALPHA-D-MANNOPYRANO-3-YL)-ALPHA-D-GALACTOFURANOSE_ORTHOACETATE |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H42O15S |
| InChI | InChI=1S/C36H42O15S/c1-6-52-35-31(46-32(40)22-13-9-7-10-14-22)29(27-25(45-35)18-42-33(47-27)23-15-11-8-12-16-23)49-36(5)50-30-28(44-21(4)39)26(48-34(30)51-36)24(43-20(3)38)17-41-19(2)37/h7-16,24-31,33-35H,6,17-18H2,1-5H3/t24?,25-,26+,27-,28+,29+,30-,31+,33-,34-,35-,36+/m1/s1 |
| InChIKey | BDUHKDVAECBTTO-CAYWZKGLSA-N |
| Literature Reference Author | B.D.JOHNSTON,B.M.PINTO |
| Literature Reference Citation | CARBOHYDR.RES.,315,356(1999) |
| Molecular Weight | 746.780 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ4637 |