| SpectraBase Compound ID | 4y61zHWYUt7 |
|---|---|
| InChI | InChI=1S/C22H31NO6/c1-5-16(24)14-8-6-9-15-18-12(2)20(21-19(27-4)13(3)22(25)29-21)28-17(18)10-7-11-23(14,15)26/h10,12,14-16,18,24H,5-9,11H2,1-4H3/b21-20-/t12-,14+,15-,16+,18+,23?/m0/s1 |
| InChIKey | XUUDPDBQUOMLQN-DZGUQGQBSA-N |
| Mol Weight | 405.49 g/mol |
| Molecular Formula | C22H31NO6 |
| Exact Mass | 405.215138 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Dh8lWkfDnPQ |
|---|---|
| Name | STEMOKERRIN-N-OXIDE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H31NO6 |
| InChI | InChI=1S/C22H31NO6/c1-5-16(24)14-8-6-9-15-18-12(2)20(21-19(27-4)13(3)22(25)29-21)28-17(18)10-7-11-23(14,15)26/h10,12,14-16,18,24H,5-9,11H2,1-4H3/b21-20-/t12-,14+,15-,16+,18+,23?/m0/s1 |
| InChIKey | XUUDPDBQUOMLQN-DZGUQGQBSA-N |
| Literature Reference Author | Y.Z.WANG,C.P.TANG,P.H.DIEN,Y.YE |
| Literature Reference Citation | J.NAT.PROD.,70,1356(2007) |
| Literature Reference DOI | 10.1021/np070099o |
| Molecular Weight | 405.491 g/mol |
| Sample ID | 31477 |
| Solvent | CDCl3 |