| SpectraBase Compound ID | 9miRyMkp0Fp |
|---|---|
| InChI | InChI=1S/C20H28O3/c1-14(10-13-21)6-8-16-15(2)7-9-17-19(16,3)11-5-12-20(17,4)18(22)23/h6,8,10,13,16-17H,2,5,7,9,11-12H2,1,3-4H3,(H,22,23)/b8-6-,14-10+/t16?,17?,19-,20+/m1/s1 |
| InChIKey | BIKTYBKSVBXGDW-PBYHAGMFSA-N |
| Mol Weight | 316.44 g/mol |
| Molecular Formula | C20H28O3 |
| Exact Mass | 316.203845 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FdNIJt4ghv3 |
|---|---|
| Name | 15-OXOLABDA-8(17),11(Z),13(E)-TRIEN-19-OIC-ACID |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H28O3 |
| InChI | InChI=1S/C20H28O3/c1-14(10-13-21)6-8-16-15(2)7-9-17-19(16,3)11-5-12-20(17,4)18(22)23/h6,8,10,13,16-17H,2,5,7,9,11-12H2,1,3-4H3,(H,22,23)/b8-6-,14-10+/t16?,17?,19-,20+/m1/s1 |
| InChIKey | BIKTYBKSVBXGDW-PBYHAGMFSA-N |
| Literature Reference Author | M.IWAMOTO,H.OHTSU,S.MATSUNAGA,R.TANAKA |
| Literature Reference Citation | J.NAT.PROD.,63,1381(2000) |
| Literature Reference DOI | 10.1021/np000025b |
| Molecular Weight | 316.441 g/mol |
| Solvent | CDCl3 |