| SpectraBase Compound ID | 38pgAaY1C6T |
|---|---|
| InChI | InChI=1S/C27H35ClO4/c1-18(2)24(28)12-11-21(26(30)31)10-6-8-19(3)9-7-14-27(5)15-13-22-17-23(29)16-20(4)25(22)32-27/h9-10,13,15-17,24,29H,1,6-8,11-12,14H2,2-5H3,(H,30,31)/b19-9+,21-10- |
| InChIKey | AQCCYRBRVYHDDZ-QOLNZVEYSA-N |
| Mol Weight | 459.0 g/mol |
| Molecular Formula | C27H35ClO4 |
| Exact Mass | 458.222387 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 88br27ZI2OQ |
|---|---|
| Name | FALLACHROMENOIC-ACID |
| Compound Number | 10 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H35ClO4 |
| InChI | InChI=1S/C27H35ClO4/c1-18(2)24(28)12-11-21(26(30)31)10-6-8-19(3)9-7-14-27(5)15-13-22-17-23(29)16-20(4)25(22)32-27/h9-10,13,15-17,24,29H,1,6-8,11-12,14H2,2-5H3,(H,30,31)/b19-9+,21-10- |
| InChIKey | AQCCYRBRVYHDDZ-QOLNZVEYSA-N |
| Literature Reference Author | P.REDDY,S.URBAN |
| Literature Reference Citation | PHYTOCHEM.,70,250(2009) |
| Literature Reference DOI | 10.1016/j.phytochem.2008.12.007 |
| Molecular Weight | 459.026 g/mol |
| Sample ID | 64503 |
| Solvent | CDCl3 |