| SpectraBase Compound ID | J53vtqqgHtN |
|---|---|
| InChI | InChI=1S/C30H48O3/c1-19-20(31)8-9-21-27(19,5)11-10-22-28(21,6)15-17-30(24(32)33)23-18-25(2,3)12-13-26(23,4)14-16-29(22,30)7/h19,21-23H,8-18H2,1-7H3,(H,32,33)/t19-,21+,22-,23+,26+,27+,28-,29+,30-/m0/s1 |
| InChIKey | DCZGJIUDCAUZMF-ZAYGEOOPSA-N |
| Mol Weight | 456.7 g/mol |
| Molecular Formula | C30H48O3 |
| Exact Mass | 456.360345 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8wiOTJ0qugr |
|---|---|
| Name | TRICHADONIC-ACID;3-OXOFRIEDELAN-27-OIC-ACID |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H48O3 |
| InChI | InChI=1S/C30H48O3/c1-19-20(31)8-9-21-27(19,5)11-10-22-28(21,6)15-17-30(24(32)33)23-18-25(2,3)12-13-26(23,4)14-16-29(22,30)7/h19,21-23H,8-18H2,1-7H3,(H,32,33)/t19-,21+,22-,23+,26+,27+,28-,29+,30-/m0/s1 |
| InChIKey | DCZGJIUDCAUZMF-ZAYGEOOPSA-N |
| Literature Reference Author | R.M.GINER-PONS,A.I.GRAY,C.LAVAUD,G.MASSIOT,S.GIBBONS,P.G.WAT ERMAN |
| Literature Reference Citation | PHYTOCHEM.,31,223(1992) |
| Literature Reference DOI | 10.1016/0031-9422(91)83041-I |
| Molecular Weight | 456.709 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU5262 |