| SpectraBase Compound ID | 44Ausg7is6g |
|---|---|
| InChI | InChI=1S/C24H28O13/c1-2-11-12-6-18(27)34-8-16(10-3-4-14(25)15(26)5-10)33-9-17-19(28)20(29)21(30)24(36-17)37-23(11)35-7-13(12)22(31)32/h2-5,7,12,16-17,19-21,23-26,28-30H,6,8-9H2,1H3,(H,31,32)/b11-2+/t12-,16+,17+,19+,20-,21+,23-,24-/m0/s1 |
| InChIKey | HYGUFHOLLCKYHM-BASFMAEZSA-N |
| Mol Weight | 524.48 g/mol |
| Molecular Formula | C24H28O13 |
| Exact Mass | 524.152991 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KCepQm0g5V7 |
|---|---|
| Name | DEMETHYL-2''-EPIFRAXAMOSIDE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C24H28O13 |
| InChI | InChI=1S/C24H28O13/c1-2-11-12-6-18(27)34-8-16(10-3-4-14(25)15(26)5-10)33-9-17-19(28)20(29)21(30)24(36-17)37-23(11)35-7-13(12)22(31)32/h2-5,7,12,16-17,19-21,23-26,28-30H,6,8-9H2,1H3,(H,31,32)/b11-2+/t12-,16+,17+,19+,20-,21+,23-,24-/m0/s1 |
| InChIKey | HYGUFHOLLCKYHM-BASFMAEZSA-N |
| Literature Reference Author | S.K.SADHU,M.S.KHAN,T.OHTSUKI,M.ISHIBASHI |
| Literature Reference Citation | PHYTOCHEM.,68,1718(2007) |
| Literature Reference DOI | 10.1016/j.phytochem.2007.04.029 |
| Molecular Weight | 524.479 g/mol |
| Sample ID | 42663 |
| Solvent | CD3OD |