| SpectraBase Compound ID | 68tiYFxQoEE |
|---|---|
| InChI | InChI=1S/C20H28O3/c1-17(2)11-5-8-20-12(18(11,3)7-6-13(17)21)9-10-14(15(20)22)19(10,4)16(20)23/h10-12,14,16,23H,5-9H2,1-4H3/t10-,11-,12+,14-,16-,18-,19+,20+/m0/s1 |
| InChIKey | NWOOYBPWWPOWNL-XCMMVXADSA-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 | 2BJQkYi88cI |
|---|---|
| Name | 15-ALPHA-HYDROXYTRACHYLOBANE-3,14-DIONE |
| Compound Number | 21 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H28O3 |
| InChI | InChI=1S/C20H28O3/c1-17(2)11-5-8-20-12(18(11,3)7-6-13(17)21)9-10-14(15(20)22)19(10,4)16(20)23/h10-12,14,16,23H,5-9H2,1-4H3/t10-,11-,12+,14-,16-,18-,19+,20+/m0/s1 |
| InChIKey | NWOOYBPWWPOWNL-XCMMVXADSA-N |
| Literature Reference Author | C.BACCELLI,I.NAVARRO,S.BLOCK,A.ABAD,N.MOREL,J.QUETIN-LECLERC Q |
| Literature Reference Citation | J.NAT.PROD.,70,910(2007) |
| Literature Reference DOI | 10.1021/np0603976 |
| Molecular Weight | 316.441 g/mol |
| Sample ID | 30379 |
| Solvent | CDCl3 |