| SpectraBase Compound ID | 6dRiDdwK8Yx |
|---|---|
| InChI | InChI=1S/C22H28O12/c23-8-14-16(26)17(27)18(28)21(33-14)34-20-15-12(5-6-31-20)13(7-22(15,30)9-24)32-19(29)10-1-3-11(25)4-2-10/h1-6,12-18,20-21,23-28,30H,7-9H2/t12-,13+,14-,15+,16-,17+,18-,20-,21+,22+/m0/s1 |
| InChIKey | OTIAAGNDDJEMIJ-VCOBKXRBSA-N |
| Mol Weight | 484.45 g/mol |
| Molecular Formula | C22H28O12 |
| Exact Mass | 484.158076 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KgnANtC2sxh |
|---|---|
| Name | 5,7-BISDEOXYCYNANCHOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H28O12 |
| InChI | InChI=1S/C22H28O12/c23-8-14-16(26)17(27)18(28)21(33-14)34-20-15-12(5-6-31-20)13(7-22(15,30)9-24)32-19(29)10-1-3-11(25)4-2-10/h1-6,12-18,20-21,23-28,30H,7-9H2/t12-,13+,14-,15+,16-,17+,18-,20-,21+,22+/m0/s1 |
| InChIKey | OTIAAGNDDJEMIJ-VCOBKXRBSA-N |
| Literature Reference Author | T.IWAGAWA,T.HAMADA,S.KUROGI,T.HASE,T.OKUBO,M.KIM |
| Literature Reference Citation | PHYTOCHEM.,30,4057(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)83466-X |
| Molecular Weight | 484.457 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU28209 |