| SpectraBase Compound ID | 3aEHr7EyPJB |
|---|---|
| InChI | InChI=1S/C23H32O6/c1-13(2)23(26)9-8-21(3)12-18-22(4,29-18)11-17(19(21)23)28-20(25)14-6-7-15(24)16(10-14)27-5/h6-7,10,13,17-19,24,26H,8-9,11-12H2,1-5H3/t17-,18-,19+,21+,22+,23+/m0/s1 |
| InChIKey | LUXHNMNHDPKHBY-CNAOLAIUSA-N |
| Mol Weight | 404.5 g/mol |
| Molecular Formula | C23H32O6 |
| Exact Mass | 404.219889 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 21Dc7BZEkSI |
|---|---|
| Name | EPOXY-JAESCHKEANADIOL-VANILLATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C23H32O6 |
| InChI | InChI=1S/C23H32O6/c1-13(2)23(26)9-8-21(3)12-18-22(4,29-18)11-17(19(21)23)28-20(25)14-6-7-15(24)16(10-14)27-5/h6-7,10,13,17-19,24,26H,8-9,11-12H2,1-5H3/t17-,18-,19+,21+,22+,23+/m0/s1 |
| InChIKey | LUXHNMNHDPKHBY-CNAOLAIUSA-N |
| Literature Reference Author | M.MISKI,T.J.MABRY,O.SAYA |
| Literature Reference Citation | J.NAT.PROD.,50,829(1987) |
| Literature Reference DOI | 10.1021/np50053a009 |
| Molecular Weight | 404.503 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED17534 |