| SpectraBase Compound ID | 1BuOKZWdtL1 |
|---|---|
| InChI | InChI=1S/C34H42O11S2/c1-22-11-15-27(16-12-22)46(35,36)44-33-24(3)42-32(19-29(33)40-21-26-9-7-6-8-10-26)43-30-20-31(39-5)41-25(4)34(30)45-47(37,38)28-17-13-23(2)14-18-28/h6-18,24-25,29-34H,19-21H2,1-5H3/t24-,25+,29-,30+,31-,32+,33-,34+/m1/s1 |
| InChIKey | KIKCVWAOTFANDJ-SQJHWDPPSA-N |
| Mol Weight | 690.8 g/mol |
| Molecular Formula | C34H42O11S2 |
| Exact Mass | 690.216855 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DMBR1lYVXHt |
|---|---|
| Name | METHYL3-O-(3-O-BENZYL-2,6-DIDEOXY-4-O-(P-TOLYLSULFONYL)-BETA-D-ARABINO-HEXAPYRANOSYL)-2,6-DIDEOXY-4-O-(P-TOLYLSULFONYL)-ALPHA-D-ARABINO-HEXAPYRANOSIDE |
| CAS Registry Number | 123567-40-8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H42O11S2 |
| InChI | InChI=1S/C34H42O11S2/c1-22-11-15-27(16-12-22)46(35,36)44-33-24(3)42-32(19-29(33)40-21-26-9-7-6-8-10-26)43-30-20-31(39-5)41-25(4)34(30)45-47(37,38)28-17-13-23(2)14-18-28/h6-18,24-25,29-34H,19-21H2,1-5H3/t24-,25+,29-,30+,31-,32+,33-,34+/m1/s1 |
| InChIKey | KIKCVWAOTFANDJ-SQJHWDPPSA-N |
| Literature Reference Author | R.W.BINKLEY,D.G.HEHEMANN |
| Literature Reference Citation | J.ORG.CHEM.,55,378(1990) |
| Literature Reference DOI | 10.1021/jo00288a074 |
| Molecular Weight | 690.821 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED12556 |