| SpectraBase Compound ID | 90qBa6GoagX |
|---|---|
| InChI | InChI=1S/C25H28O14/c1-10-18-16(7-8-32-24(18)31)20(19(10)34-12(3)27)39-25-23(37-15(6)30)22(36-14(5)29)21(35-13(4)28)17(38-25)9-33-11(2)26/h7-8,17,19-23,25H,1,9H2,2-6H3/t17-,19+,20-,21-,22+,23-,25+/m0/s1 |
| InChIKey | HCQQUYJMKPQNCP-YZMCDTNESA-N |
| Mol Weight | 552.49 g/mol |
| Molecular Formula | C25H28O14 |
| Exact Mass | 552.147906 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7nW0cetUx3C |
|---|---|
| Name | CHAENORRHINOSIDE-PENTAACETATE |
| Compound Number | 2A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H28O14 |
| InChI | InChI=1S/C25H28O14/c1-10-18-16(7-8-32-24(18)31)20(19(10)34-12(3)27)39-25-23(37-15(6)30)22(36-14(5)29)21(35-13(4)28)17(38-25)9-33-11(2)26/h7-8,17,19-23,25H,1,9H2,2-6H3/t17-,19+,20-,21-,22+,23-,25+/m0/s1 |
| InChIKey | HCQQUYJMKPQNCP-YZMCDTNESA-N |
| Literature Reference Author | J.BREINHOLT,J.S.JENSEN,S.R.JENSEN,B.J.NIELSEN |
| Literature Reference Citation | PHYTOCHEM.,29,3865(1990) |
| Literature Reference DOI | 10.1016/0031-9422(90)85348-J |
| Molecular Weight | 552.489 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS26051 |