| SpectraBase Compound ID | KTTvAenplRJ |
|---|---|
| InChI | InChI=1S/C21H22O10/c1-8-15(25)17(27)18(28)21(29-8)31-20-16(26)14-12(24)6-11(23)7-13(14)30-19(20)9-2-4-10(22)5-3-9/h2-8,15,17-25,27-28H,1H3/t8-,15-,17+,18+,19+,20-,21-/m0/s1 |
| InChIKey | VQUPQWGKORWZII-WDPYGAQVSA-N |
| Mol Weight | 434.4 g/mol |
| Molecular Formula | C21H22O10 |
| Exact Mass | 434.121297 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Gnmmi7GKns |
|---|---|
| Name | ISOENGELETIN |
| Compound Number | 12 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H22O10 |
| InChI | InChI=1S/C21H22O10/c1-8-15(25)17(27)18(28)21(29-8)31-20-16(26)14-12(24)6-11(23)7-13(14)30-19(20)9-2-4-10(22)5-3-9/h2-8,15,17-25,27-28H,1H3/t8-,15-,17+,18+,19+,20-,21-/m0/s1 |
| InChIKey | VQUPQWGKORWZII-WDPYGAQVSA-N |
| Literature Reference Author | D.H.S.SILVA,M.YOSHIDA,M.J.KATO |
| Literature Reference Citation | PHYTOCHEM.,46,579(1997) |
| Literature Reference DOI | 10.1016/s0031-9422(97)00306-3 |
| Molecular Weight | 434.400 g/mol |
| Sample ID | 44911 |
| Solvent | DMSO-D6 |