| SpectraBase Compound ID | 8KoYz4eGfsK |
|---|---|
| InChI | InChI=1S/C30H46O2/c1-20(2)9-8-10-21(19-31)22-13-17-30(7)24-11-12-25-27(3,4)26(32)15-16-28(25,5)23(24)14-18-29(22,30)6/h9,11,19,21-23,25H,8,10,12-18H2,1-7H3/t21-,22+,23?,25?,28-,29+,30-/m1/s1 |
| InChIKey | FKSBBGKUFRQNEB-ZHNUXVSDSA-N |
| Mol Weight | 438.7 g/mol |
| Molecular Formula | C30H46O2 |
| Exact Mass | 438.349781 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2Hx6pziBihG |
|---|---|
| Name | 3-OXO-TIRUCALLA-7,24-DIEN-21-AL |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O2 |
| InChI | InChI=1S/C30H46O2/c1-20(2)9-8-10-21(19-31)22-13-17-30(7)24-11-12-25-27(3,4)26(32)15-16-28(25,5)23(24)14-18-29(22,30)6/h9,11,19,21-23,25H,8,10,12-18H2,1-7H3/t21-,22+,23?,25?,28-,29+,30-/m1/s1 |
| InChIKey | FKSBBGKUFRQNEB-ZHNUXVSDSA-N |
| Literature Reference Author | D.A.MULHOLLAND,M.KOTSOS,H.A.MAHOMED,D.A.H.TAYLOR |
| Literature Reference Citation | PHYTOCHEM.,49,2457(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00307-0 |
| Molecular Weight | 438.694 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU1069 |