| SpectraBase Compound ID | INZJGrMOrzp |
|---|---|
| InChI | InChI=1S/C21H22O12/c22-6-8-4-9(20(30)31)14(11(25)5-8)17(27)15-10(24)2-1-3-12(15)32-21-19(29)18(28)16(26)13(7-23)33-21/h1-5,13,16,18-19,21-26,28-29H,6-7H2,(H,30,31)/t13-,16-,18+,19-,21-/m1/s1 |
| InChIKey | AJVXGBZXQGUAOU-GUTCHGCDSA-N |
| Mol Weight | 466.4 g/mol |
| Molecular Formula | C21H22O12 |
| Exact Mass | 466.111126 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | JDtU4CEPFJJ |
|---|---|
| Name | CASSIAPHENONE_A-2-GLUCOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H22O12 |
| InChI | InChI=1S/C21H22O12/c22-6-8-4-9(20(30)31)14(11(25)5-8)17(27)15-10(24)2-1-3-12(15)32-21-19(29)18(28)16(26)13(7-23)33-21/h1-5,13,16,18-19,21-26,28-29H,6-7H2,(H,30,31)/t13-,16-,18+,19-,21-/m1/s1 |
| InChIKey | AJVXGBZXQGUAOU-GUTCHGCDSA-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 | 466.398 g/mol |
| Solvent | D2O |
| Source File Reference | UIAP1725 |