| SpectraBase Compound ID | EKgRPvRNHkl |
|---|---|
| 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-UNQYGWCUSA-N |
| Mol Weight | 436.6 g/mol |
| Molecular Formula | C28H36O4 |
| Exact Mass | 436.26136 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 19GQyUarD0k |
|---|---|
| Name | 20-HYDROXY-20-EPI-TINGENONE |
| Compound Number | 2 |
| 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-UNQYGWCUSA-N |
| Literature Reference Author | O.NGASSAPA,D.D.SOEJARTO,J.M.PEZZUTO,N.R.FARNSWORTH |
| Literature Reference Citation | J.NAT.PROD.,57,1(1994) |
| Literature Reference DOI | 10.1021/np50103a001 |
| Molecular Weight | 436.591 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS17802 |