| SpectraBase Compound ID | 4DTM9T2mKGM |
|---|---|
| InChI | InChI=1S/C30H48O3/c1-19(21(31)11-13-25(2,3)33)20-10-14-28(7)23-9-8-22-26(4,5)24(32)12-15-29(22)18-30(23,29)17-16-27(20,28)6/h11,13,19-23,31,33H,8-10,12,14-18H2,1-7H3/b13-11+/t19-,20+,21?,22?,23-,27+,28-,29+,30-/m0/s1 |
| InChIKey | FGKUHDXMDDMVEC-IZXIWLMVSA-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 | AezXnAO8cfu |
|---|---|
| Name | 22,25-DIHYDROXYCYCLOART-23E-EN-3-ONE |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H48O3 |
| InChI | InChI=1S/C30H48O3/c1-19(21(31)11-13-25(2,3)33)20-10-14-28(7)23-9-8-22-26(4,5)24(32)12-15-29(22)18-30(23,29)17-16-27(20,28)6/h11,13,19-23,31,33H,8-10,12,14-18H2,1-7H3/b13-11+/t19-,20+,21?,22?,23-,27+,28-,29+,30-/m0/s1 |
| InChIKey | FGKUHDXMDDMVEC-IZXIWLMVSA-N |
| Literature Reference Author | J.H.G.LAGO,N.F.ROQUE |
| Literature Reference Citation | PHYTOCHEM.,60,329(2002) |
| Literature Reference DOI | 10.1016/S0031-9422(02)00123-1 |
| Molecular Weight | 456.709 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS1627 |