| SpectraBase Compound ID | 43QVOuFAUDs |
|---|---|
| InChI | InChI=1S/C21H20O13/c22-6-12-15(25)17(27)18(28)21(34-12)33-11-3-1-2-9(23)14(11)16(26)13-8(20(31)32)4-7(19(29)30)5-10(13)24/h1-5,12,15,17-18,21-25,27-28H,6H2,(H,29,30)(H,31,32)/t12-,15-,17+,18-,21-/m1/s1 |
| InChIKey | WGJHPDSSDQSAFA-QUCXHVEGSA-N |
| Mol Weight | 480.38 g/mol |
| Molecular Formula | C21H20O13 |
| Exact Mass | 480.090391 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A0T2WyHpAKp |
|---|---|
| Name | CASSIAPHENONE_B-2-GLUCOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H20O13 |
| InChI | InChI=1S/C21H20O13/c22-6-12-15(25)17(27)18(28)21(34-12)33-11-3-1-2-9(23)14(11)16(26)13-8(20(31)32)4-7(19(29)30)5-10(13)24/h1-5,12,15,17-18,21-25,27-28H,6H2,(H,29,30)(H,31,32)/t12-,15-,17+,18-,21-/m1/s1 |
| InChIKey | WGJHPDSSDQSAFA-QUCXHVEGSA-N |
| Literature Reference Author | C.TERREAUX,Q.WANG,J.IOSET,K.NDJOKO,W.GRIMMINGER,K.HOSTETTMAN N |
| Literature Reference Citation | PLANTA.MED.,68,349(2002) |
| Literature Reference DOI | 10.1055/s-2002-26738 |
| Molecular Weight | 480.382 g/mol |
| Solvent | D2O |
| Source File Reference | UIAP1726 |