| SpectraBase Compound ID | A8znlonzZbs |
|---|---|
| InChI | InChI=1S/C31H50O3/c1-26(2)22-10-9-21-20(29(22,5)13-12-24(26)32)11-14-31(7)23-19-28(4,25(33)34-8)16-15-27(23,3)17-18-30(21,31)6/h22-24,32H,9-19H2,1-8H3/t22-,23+,24+,27+,28+,29+,30+,31-/m0/s1 |
| InChIKey | IJDQMHLTSFOBDC-CPGFUTRPSA-N |
| Mol Weight | 470.7 g/mol |
| Molecular Formula | C31H50O3 |
| Exact Mass | 470.375995 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HbjvARpCtoP |
|---|---|
| Name | METHYL-BRYONOLATE;METHYL-3-BETA-HYDROXY-D:C-FRIEDOOLEAN-8-EN-29-OATE |
| Compound Number | 163 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H50O3 |
| InChI | InChI=1S/C31H50O3/c1-26(2)22-10-9-21-20(29(22,5)13-12-24(26)32)11-14-31(7)23-19-28(4,25(33)34-8)16-15-27(23,3)17-18-30(21,31)6/h22-24,32H,9-19H2,1-8H3/t22-,23+,24+,27+,28+,29+,30+,31-/m0/s1 |
| InChIKey | IJDQMHLTSFOBDC-CPGFUTRPSA-N |
| Literature Reference Author | S.B.MAHATO,A.P.KUNDU |
| Literature Reference Citation | PHYTOCHEM.,37,1517(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)89569-2 |
| Molecular Weight | 470.736 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS5263 |