| SpectraBase Compound ID | BEcvB3HoWpL |
|---|---|
| InChI | InChI=1S/C40H54O/c1-31(2)17-13-20-34(5)23-15-25-35(6)24-14-21-32(3)18-11-12-19-33(4)22-16-26-36(7)27-28-39-37(8)29-38(41)30-40(39,9)10/h11-28,38,41H,29-30H2,1-10H3/b12-11+,20-13-,21-14+,22-16+,25-15+,28-27+,32-18+,33-19+,34-23-,35-24+,36-26+/t38-/m1/s1 |
| InChIKey | YYAZSYBBIFIQJT-VQIXHKMUSA-N |
| Mol Weight | 550.9 g/mol |
| Molecular Formula | C40H54O |
| Exact Mass | 550.417466 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 77sK3gmkdEz |
|---|---|
| Name | (3'-Z,5'-Z)-CELAXANTHIN |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H54O |
| InChI | InChI=1S/C40H54O/c1-31(2)17-13-20-34(5)23-15-25-35(6)24-14-21-32(3)18-11-12-19-33(4)22-16-26-36(7)27-28-39-37(8)29-38(41)30-40(39,9)10/h11-28,38,41H,29-30H2,1-10H3/b12-11+,20-13-,21-14+,22-16+,25-15+,28-27+,32-18+,33-19+,34-23-,35-24+,36-26+/t38-/m1/s1 |
| InChIKey | YYAZSYBBIFIQJT-VQIXHKMUSA-N |
| Literature Reference Author | T.MAOKA |
| Literature Reference Citation | PHYTOCHEM.,70,920(2009) |
| Literature Reference DOI | 10.1016/j.phytochem.2009.04.018 |
| Molecular Weight | 550.868 g/mol |
| Sample ID | 40763 |
| Solvent | CDCl3 |