![#19;1,4-ANHYDRO-2,3,5,6-DI-O-ISOPROPYLIDENE-1-[(S)-[(2'R,3'S,4'R,5'R)-2',4'-BENZYLIDENEDIOXY-5',6'-ISOPROPYLIDENEDIOXY-3'-(SULFOOXY)-HEXYL]-SULFONIO]-D-TALITOL](/api/spectrum/64KKxtwcANY/structure.png?h=300&w=458 "#19;1,4-ANHYDRO-2,3,5,6-DI-O-ISOPROPYLIDENE-1-[(S)-[(2'R,3'S,4'R,5'R)-2',4'-BENZYLIDENEDIOXY-5',6'-ISOPROPYLIDENEDIOXY-3'-(SULFOOXY)-HEXYL]-SULFONIO]-D-TALITOL")
| SpectraBase Compound ID | 81O529giK67 |
|---|---|
| InChI | InChI=1S/C28H40O12S2/c1-26(2)32-12-17(36-26)21-22(40-42(29,30)31)19(34-25(35-21)16-10-8-7-9-11-16)14-41-15-20-23(39-28(5,6)38-20)24(41)18-13-33-27(3,4)37-18/h7-11,17-25H,12-15H2,1-6H3/t17-,18-,19+,20-,21-,22-,23-,24+,25?,41?/m1/s1 |
| InChIKey | PXNNZMBSSNVHJQ-JWUVNIGFSA-N |
| Mol Weight | 632.7 g/mol |
| Molecular Formula | C28H40O12S2 |
| Exact Mass | 632.196119 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 64KKxtwcANY |
|---|---|
| Name | #19;1,4-ANHYDRO-2,3,5,6-DI-O-ISOPROPYLIDENE-1-[(S)-[(2'R,3'S,4'R,5'R)-2',4'-BENZYLIDENEDIOXY-5',6'-ISOPROPYLIDENEDIOXY-3'-(SULFOOXY)-HEXYL]-SULFONIO]-D-TALITOL |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H40O12S2 |
| InChI | InChI=1S/C28H40O12S2/c1-26(2)32-12-17(36-26)21-22(40-42(29,30)31)19(34-25(35-21)16-10-8-7-9-11-16)14-41-15-20-23(39-28(5,6)38-20)24(41)18-13-33-27(3,4)37-18/h7-11,17-25H,12-15H2,1-6H3/t17-,18-,19+,20-,21-,22-,23-,24+,25?,41?/m1/s1 |
| InChIKey | PXNNZMBSSNVHJQ-JWUVNIGFSA-N |
| Literature Reference Author | H.LIU,B.M.PINTO |
| Literature Reference Citation | CAN.J.CHEM.,84,497(2006) |
| Literature Reference DOI | 10.1139/v06-027 |
| Molecular Weight | 632.738 g/mol |
| Sample ID | 46851 |
| Solvent | CD2Cl2 |