| SpectraBase Compound ID | 2s96Wx4r8iW |
|---|---|
| InChI | InChI=1S/C22H36O6/c1-8-13(2)16-20(5,15(23)9-10-28-7)17-14(3)11-19(4,25)12-22(17,27)18(24)21(16,6)26/h9-10,13-14,16-17,25-27H,8,11-12H2,1-7H3/b10-9+/t13?,14-,16-,17-,19-,20-,21+,22-/m1/s1 |
| InChIKey | ONZDNBGTAVEQQN-FJXLOMMUSA-N |
| Mol Weight | 396.5 g/mol |
| Molecular Formula | C22H36O6 |
| Exact Mass | 396.251189 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FYSAiUI6gkS |
|---|---|
| Name | 10-HYDROXY-18-METHOXYLBETAENONE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H36O6 |
| InChI | InChI=1S/C22H36O6/c1-8-13(2)16-20(5,15(23)9-10-28-7)17-14(3)11-19(4,25)12-22(17,27)18(24)21(16,6)26/h9-10,13-14,16-17,25-27H,8,11-12H2,1-7H3/b10-9+/t13?,14-,16-,17-,19-,20-,21+,22-/m1/s1 |
| InChIKey | ONZDNBGTAVEQQN-FJXLOMMUSA-N |
| Literature Reference Author | G.BRAUERS,R.A.EDRADA,R.EBEL,P.PROKSCH,V.WRAY,A.BERG,U.GRAEFE ,C.SCHAECHTELE,F.TOT |
| Literature Reference Citation | J.NAT.PROD.,63,739(2000) |
| Literature Reference DOI | 10.1021/np9905259 |
| Molecular Weight | 396.524 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWRU8209 |