| SpectraBase Compound ID | 4UDNLzLbpxK |
|---|---|
| InChI | InChI=1S/C28H36O4/c1-16-17-7-8-20-25(3,18(17)13-19(29)23(16)31)10-12-27(5)21-14-28(6,32)22(30)15-24(21,2)9-11-26(20,27)4/h7-8,13,21,31-32H,9-12,14-15H2,1-6H3/t21-,24+,25+,26-,27+,28-/m1/s1 |
| InChIKey | LLINHWDEBZOLGN-CVDLMKFLSA-N |
| Mol Weight | 436.6 g/mol |
| Molecular Formula | C28H36O4 |
| Exact Mass | 436.26136 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GYwkfHjyJid |
|---|---|
| Name | 20-HYDROXY-20-EPI-TINGENONE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H36O4 |
| InChI | InChI=1S/C28H36O4/c1-16-17-7-8-20-25(3,18(17)13-19(29)23(16)31)10-12-27(5)21-14-28(6,32)22(30)15-24(21,2)9-11-26(20,27)4/h7-8,13,21,31-32H,9-12,14-15H2,1-6H3/t21-,24+,25+,26-,27+,28-/m1/s1 |
| InChIKey | LLINHWDEBZOLGN-CVDLMKFLSA-N |
| Literature Reference Author | K.LIKHITWITAYAWUID,R.BAVOVADA,L.Z.LIN,G.A.CORDELL |
| Literature Reference Citation | PHYTOCHEM.,34,759(1993) |
| Literature Reference DOI | 10.1016/0031-9422(93)85355-U |
| Molecular Weight | 436.591 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN6661 |