| SpectraBase Compound ID | JL6RMAEScpj |
|---|---|
| InChI | InChI=1S/C30H46O3/c1-19(9-8-10-20(2)26(32)33)21-13-17-30(7)23-11-12-24-27(3,4)25(31)15-16-28(24,5)22(23)14-18-29(21,30)6/h10-11,19,21-22,24H,8-9,12-18H2,1-7H3,(H,32,33)/b20-10-/t19?,21-,22?,24?,28+,29-,30+/m0/s1 |
| InChIKey | VOYZLKWKVLYJHD-SQOMGICQSA-N |
| Mol Weight | 454.7 g/mol |
| Molecular Formula | C30H46O3 |
| Exact Mass | 454.344695 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8elMWm7ls2o |
|---|---|
| Name | 3-OXO-TIRUCALLA-7,24Z-DIEN-26-OIC-ACID |
| Compound Number | 1B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O3 |
| InChI | InChI=1S/C30H46O3/c1-19(9-8-10-20(2)26(32)33)21-13-17-30(7)23-11-12-24-27(3,4)25(31)15-16-28(24,5)22(23)14-18-29(21,30)6/h10-11,19,21-22,24H,8-9,12-18H2,1-7H3,(H,32,33)/b20-10-/t19?,21-,22?,24?,28+,29-,30+/m0/s1 |
| InChIKey | VOYZLKWKVLYJHD-SQOMGICQSA-N |
| Literature Reference Author | MD.R.CAMACHO,R.MATA,P.CASTANEDA,G.C.KIRBY,D.C.WARHURST,S.L.C ROFT,J.D.PHILLIPSON |
| Literature Reference Citation | PLANTA.MED.,66,463(2000) |
| Literature Reference DOI | 10.1055/s-2000-8598 |
| Molecular Weight | 454.693 g/mol |
| Solvent | CDCl3 |