| SpectraBase Compound ID | IMb8B729Wix |
|---|---|
| InChI | InChI=1S/C28H32O14/c1-38-26-11(6-7-14-17(26)19(31)13-5-3-2-4-12(13)18(14)30)9-39-27-25(37)23(35)21(33)16(42-27)10-40-28-24(36)22(34)20(32)15(8-29)41-28/h2-7,15-16,20-25,27-29,32-37H,8-10H2,1H3/t15-,16-,20-,21-,22+,23+,24-,25-,27-,28-/m0/s1 |
| InChIKey | SUMBQEYVDCBORT-CHTVWNPQSA-N |
| Mol Weight | 592.6 g/mol |
| Molecular Formula | C28H32O14 |
| Exact Mass | 592.179206 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BPbB731uwRw |
|---|---|
| Name | DIGIFERRUGINOL-1-METHYLETHER-11-O-BETA-GENTIOBIOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H32O14 |
| InChI | InChI=1S/C28H32O14/c1-38-26-11(6-7-14-17(26)19(31)13-5-3-2-4-12(13)18(14)30)9-39-27-25(37)23(35)21(33)16(42-27)10-40-28-24(36)22(34)20(32)15(8-29)41-28/h2-7,15-16,20-25,27-29,32-37H,8-10H2,1H3/t15-,16-,20-,21-,22+,23+,24-,25-,27-,28-/m0/s1 |
| InChIKey | SUMBQEYVDCBORT-CHTVWNPQSA-N |
| Literature Reference Author | K.KAMIYA,W.HAMABE,S.TOKUYAMA,T.SATAKE |
| Literature Reference Citation | FITOTERAPIA,80,196(2009) |
| Literature Reference DOI | 10.1016/j.fitote.2009.01.014 |
| Molecular Weight | 592.554 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWMB310 |