| SpectraBase Compound ID | 7zBDvxIIb0X |
|---|---|
| InChI | InChI=1S/C35H40O11/c1-6-13(2)26(37)44-12-33(42)20-7-17(20)30(4)21(33)9-16-15(11-36)28(39)45-34(16)22(30)10-32(41)19-8-18(19)31(5)25(32)24(34)23-14(3)27(38)46-35(23,43)29(31)40/h6,17-22,29,36,40-43H,7-12H2,1-5H3/b13-6+/t17-,18-,19+,20+,21-,22+,29-,30+,31+,32+,33+,34+,35+/m1/s1 |
| InChIKey | JDNYCIQWGHMSPJ-ANOWQDLRSA-N |
| Mol Weight | 636.7 g/mol |
| Molecular Formula | C35H40O11 |
| Exact Mass | 636.257062 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ch2exUMFjEh |
|---|---|
| Name | HENRIOL-B |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H40O11 |
| InChI | InChI=1S/C35H40O11/c1-6-13(2)26(37)44-12-33(42)20-7-17(20)30(4)21(33)9-16-15(11-36)28(39)45-34(16)22(30)10-32(41)19-8-18(19)31(5)25(32)24(34)23-14(3)27(38)46-35(23,43)29(31)40/h6,17-22,29,36,40-43H,7-12H2,1-5H3/b13-6+/t17-,18-,19+,20+,21-,22+,29-,30+,31+,32+,33+,34+,35+/m1/s1 |
| InChIKey | JDNYCIQWGHMSPJ-ANOWQDLRSA-N |
| Literature Reference Author | C.J.LI,D.M.ZHANG,Y.M.LUO,S.S.YU,Y.LU |
| Literature Reference Citation | PHYTOCHEM.,69,2867(2008) |
| Literature Reference DOI | 10.1016/j.phytochem.2008.08.022 |
| Molecular Weight | 636.696 g/mol |
| Sample ID | 63785 |
| Solvent | ACETONE-D6 |