| SpectraBase Compound ID | Amfm4T1pZIN |
|---|---|
| InChI | InChI=1S/C36H56O7/c1-21(19-27(37)22(2)23(3)32(40)42-10)24-13-17-36(8)26-11-12-28-33(4,5)29(43-31(39)20-30(38)41-9)15-16-34(28,6)25(26)14-18-35(24,36)7/h21-24,28-29H,11-20H2,1-10H3/t21-,22+,23+,24-,28+,29-,34-,35-,36+/m1/s1 |
| InChIKey | MSXVALCSTTYOHS-MAYRATFMSA-N |
| Mol Weight | 600.8 g/mol |
| Molecular Formula | C36H56O7 |
| Exact Mass | 600.402604 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CgdEZOC1Fbg |
|---|---|
| Name | DIMETHYL-CARBOXYACETYL-QUERCINATE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H56O7 |
| InChI | InChI=1S/C36H56O7/c1-21(19-27(37)22(2)23(3)32(40)42-10)24-13-17-36(8)26-11-12-28-33(4,5)29(43-31(39)20-30(38)41-9)15-16-34(28,6)25(26)14-18-35(24,36)7/h21-24,28-29H,11-20H2,1-10H3/t21-,22+,23+,24-,28+,29-,34-,35-,36+/m1/s1 |
| InChIKey | MSXVALCSTTYOHS-MAYRATFMSA-N |
| Literature Reference Author | CHAIRUL,T.TOKUYAMA,M.NISHIZAWA,M.SHIRO,H.TOKUDA,Y.HAYASHI |
| Literature Reference Citation | PHYTOCHEM.,29,923(1990) |
| Literature Reference DOI | 10.1016/0031-9422(90)80047-K |
| Molecular Weight | 600.836 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN29473 |