| SpectraBase Compound ID | 4mIsIpCojN8 |
|---|---|
| InChI | InChI=1S/C30H50O3/c1-20(9-8-14-25(2,3)33-32)21-12-15-28(7)23-11-10-22-26(4,5)24(31)13-16-29(22)19-30(23,29)18-17-27(21,28)6/h8,14,20-24,31-32H,9-13,15-19H2,1-7H3/b14-8+/t20-,21-,22+,23+,24+,27+,28-,29-,30+/m1/s1 |
| InChIKey | QVDQRPBOZUHTCX-FRDMYHOKSA-N |
| Mol Weight | 458.7 g/mol |
| Molecular Formula | C30H50O3 |
| Exact Mass | 458.375995 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5sKFczQvQw6 |
|---|---|
| Name | 25-HYDROPEROXY-CYClOART-23-EN-3-BETA-OL |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H50O3 |
| InChI | InChI=1S/C30H50O3/c1-20(9-8-14-25(2,3)33-32)21-12-15-28(7)23-11-10-22-26(4,5)24(31)13-16-29(22)19-30(23,29)18-17-27(21,28)6/h8,14,20-24,31-32H,9-13,15-19H2,1-7H3/b14-8+/t20-,21-,22+,23+,24+,27+,28-,29-,30+/m1/s1 |
| InChIKey | QVDQRPBOZUHTCX-FRDMYHOKSA-N |
| Literature Reference Author | T.KATO,B.FREI,M.HEINRICH,O.STICHER |
| Literature Reference Citation | PHYTOCHEM.,41,1191(1996) |
| Literature Reference DOI | 10.1016/0031-9422(95)00765-2 |
| Molecular Weight | 458.725 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU4320 |