| SpectraBase Compound ID | 25BxmGtDkpf |
|---|---|
| InChI | InChI=1S/C26H33NO4/c1-5-17(2)14-19(4)15-18(3)8-6-7-9-23(29)24-25(30)22(27-26(24)31)16-20-10-12-21(28)13-11-20/h6-13,15,17,19,22,28-29H,5,14,16H2,1-4H3,(H,27,31)/b8-6+,9-7+,18-15+,24-23+/t17-,19-,22?/m1/s1 |
| InChIKey | OHRSQSHXRITGEV-WNHHMECXSA-N |
| Mol Weight | 423.6 g/mol |
| Molecular Formula | C26H33NO4 |
| Exact Mass | 423.240959 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G2uNzjchQIi |
|---|---|
| Name | MILITARINONE-C;5-(4-HYDROXYPHENYL)-3-(1-HYDROXY-6,8,10-TRIMETHYLDODECA-2,4,6-TRIENYLIDENE)-PYRROLIDINE-2,4-DIONE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H33NO4 |
| InChI | InChI=1S/C26H33NO4/c1-5-17(2)14-19(4)15-18(3)8-6-7-9-23(29)24-25(30)22(27-26(24)31)16-20-10-12-21(28)13-11-20/h6-13,15,17,19,22,28-29H,5,14,16H2,1-4H3,(H,27,31)/b8-6+,9-7+,18-15+,24-23+/t17-,19-,22?/m1/s1 |
| InChIKey | OHRSQSHXRITGEV-WNHHMECXSA-N |
| Literature Reference Author | K.SCHMIDT,U.RIESE,Z.LI,M.HAMBURGER |
| Literature Reference Citation | J.NAT.PROD.,66,378(2003) |
| Literature Reference DOI | 10.1021/np020430y |
| Molecular Weight | 423.552 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWSI4631 |