| SpectraBase Compound ID | 4hEYNKveJIu |
|---|---|
| InChI | InChI=1S/C21H30O14/c1-7-4-10(24)21(35-20-17(30)15(28)13(26)9(6-23)33-20)2-3-31-18(11(7)21)34-19-16(29)14(27)12(25)8(5-22)32-19/h2-4,8-9,11-20,22-23,25-30H,5-6H2,1H3/t8-,9+,11?,12-,13+,14+,15+,16-,17+,18-,19+,20-,21+/m1/s1 |
| InChIKey | VIEGIQFDBMKKSH-CJJZPEFCSA-N |
| Mol Weight | 506.46 g/mol |
| Molecular Formula | C21H30O14 |
| Exact Mass | 506.163556 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KfGDmCW9lcA |
|---|---|
| Name | ALLOBETONICOSIDE |
| Compound Number | 19 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H30O14 |
| InChI | InChI=1S/C21H30O14/c1-7-4-10(24)21(35-20-17(30)15(28)13(26)9(6-23)33-20)2-3-31-18(11(7)21)34-19-16(29)14(27)12(25)8(5-22)32-19/h2-4,8-9,11-20,22-23,25-30H,5-6H2,1H3/t8-,9+,11?,12-,13+,14+,15+,16-,17+,18-,19+,20-,21+/m1/s1 |
| InChIKey | VIEGIQFDBMKKSH-CJJZPEFCSA-N |
| Literature Reference Author | C.A.BOROS,F.R.STERMITZ |
| Literature Reference Citation | J.NAT.PROD.,53,1055(1990) |
| Literature Reference DOI | 10.1021/np50071a001 |
| Molecular Weight | 506.461 g/mol |
| Solvent | D2O |
| Source File Reference | UWMZ16016 |