| SpectraBase Compound ID | exQCLknr8H |
|---|---|
| InChI | InChI=1S/C41H66O2/c1-10-11-12-13-14-15-16-17-36(42)43-35-23-25-40-28-41(40)27-26-38(8)32(31(5)19-18-30(4)29(2)3)22-24-39(38,9)34(41)21-20-33(40)37(35,6)7/h14-17,29,31-35H,4,10-13,18-28H2,1-3,5-9H3/b15-14+,17-16+/t31-,32-,33+,34+,35+,38-,39+,40-,41+/m1/s1 |
| InChIKey | KJCDIXARAHBDPC-WCGUHVHZSA-N |
| Mol Weight | 591.0 g/mol |
| Molecular Formula | C41H66O2 |
| Exact Mass | 590.506281 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6lUvnnpiruJ |
|---|---|
| Name | 24-METHYLENECYCLOARTANYL-2'-E,4'-E-DECADIENOATE |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H66O2 |
| InChI | InChI=1S/C41H66O2/c1-10-11-12-13-14-15-16-17-36(42)43-35-23-25-40-28-41(40)27-26-38(8)32(31(5)19-18-30(4)29(2)3)22-24-39(38,9)34(41)21-20-33(40)37(35,6)7/h14-17,29,31-35H,4,10-13,18-28H2,1-3,5-9H3/b15-14+,17-16+/t31-,32-,33+,34+,35+,38-,39+,40-,41+/m1/s1 |
| InChIKey | KJCDIXARAHBDPC-WCGUHVHZSA-N |
| Literature Reference Author | H.HABA,C.LAVAUD,A.A.MAGID,M.BENKHALED |
| Literature Reference Citation | J.NAT.PROD.,72,1258(2009) |
| Literature Reference DOI | 10.1021/np900127j |
| Molecular Weight | 590.974 g/mol |
| Sample ID | 33175 |
| Solvent | CDCl3 |