| SpectraBase Compound ID | 1bp2OwHsqDy |
|---|---|
| InChI | InChI=1S/C27H42O4/c1-17-8-9-19(14-20(17)29)27(30)13-10-22-25(5,16-27)15-21(31-18(2)28)23-24(3,4)11-7-12-26(22,23)6/h8,19,21-23,30H,7,9-16H2,1-6H3/t19-,21?,22?,23?,25?,26?,27+/m0/s1 |
| InChIKey | ZTMQHXLRDHJYRQ-XKOZSLTKSA-N |
| Mol Weight | 430.6 g/mol |
| Molecular Formula | C27H42O4 |
| Exact Mass | 430.30831 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EU0j07qYsi4 |
|---|---|
| Name | 19-Episuberitenone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H42O4 |
| InChI | InChI=1S/C27H42O4/c1-17-8-9-19(14-20(17)29)27(30)13-10-22-25(5,16-27)15-21(31-18(2)28)23-24(3,4)11-7-12-26(22,23)6/h8,19,21-23,30H,7,9-16H2,1-6H3/t19-,21?,22?,23?,25?,26?,27+/m0/s1 |
| InChIKey | ZTMQHXLRDHJYRQ-XKOZSLTKSA-N |
| Molecular Weight | 430.629 g/mol |
| SMILES | O[C@@]1(CCC2C(C1)(C)CC(C1C2(CCCC1(C)C)C)OC(=O)C)[C@@]1(CC(=O)C(=CC1)C)[H] |
| SPLASH | splash10-0w2c-0039500000-c1e840eb920e3b1e23c9 |
| Source of Spectrum | Y1-45-4710-2 |
| Wiley ID | 1622047 |