| SpectraBase Compound ID | 91LsYPAzLEF |
|---|---|
| InChI | InChI=1S/C26H30O7/c1-22(2)16-12-17(27)25(5)15(23(16,3)9-7-18(28)32-22)6-10-24(4)19(14-8-11-30-13-14)31-21(29)20-26(24,25)33-20/h7-9,11,13,15-16,19-20H,6,10,12H2,1-5H3/t15-,16+,19+,20-,23-,24+,25+,26-/m1/s1 |
| InChIKey | MAYJEFRPIKEYBL-OASIGRBWSA-N |
| Mol Weight | 454.52 g/mol |
| Molecular Formula | C26H30O7 |
| Exact Mass | 454.199153 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GPlGugNoewr |
|---|---|
| Name | OBACUNONE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H30O7 |
| InChI | InChI=1S/C26H30O7/c1-22(2)16-12-17(27)25(5)15(23(16,3)9-7-18(28)32-22)6-10-24(4)19(14-8-11-30-13-14)31-21(29)20-26(24,25)33-20/h7-9,11,13,15-16,19-20H,6,10,12H2,1-5H3/t15-,16+,19+,20-,23-,24+,25+,26-/m1/s1 |
| InChIKey | MAYJEFRPIKEYBL-OASIGRBWSA-N |
| Literature Reference Author | J.K.MACLEOD,P.D.R.MOELLER,B.M.R.BANDARA,A.A.L.GUNATILAKA,E.M .WIJERATNE |
| Literature Reference Citation | J.NAT.PROD.,52,882(1989) |
| Literature Reference DOI | 10.1021/np50064a040 |
| Molecular Weight | 454.520 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED18110 |