| SpectraBase Compound ID | Cy82ujpS4tl |
|---|---|
| InChI | InChI=1S/C40H54O4/c1-28(17-13-18-30(3)21-22-36-32(5)23-34(41)25-38(36,7)8)15-11-12-16-29(2)19-14-20-31(4)37(43)27-40(44)33(6)24-35(42)26-39(40,9)10/h11-20,33-34,41,44H,23-27H2,1-10H3/b12-11-,17-13+,19-14+,28-15-,29-16+,30-18+,31-20+ |
| InChIKey | BNDHJHDWBOVXQE-INYJMGAFSA-N |
| Mol Weight | 598.9 g/mol |
| Molecular Formula | C40H54O4 |
| Exact Mass | 598.40221 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 547JMJZF89I |
|---|---|
| Name | Isomytiloxanthin |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C40H54O4 |
| InChI | InChI=1S/C40H54O4/c1-28(17-13-18-30(3)21-22-36-32(5)23-34(41)25-38(36,7)8)15-11-12-16-29(2)19-14-20-31(4)37(43)27-40(44)33(6)24-35(42)26-39(40,9)10/h11-20,33-34,41,44H,23-27H2,1-10H3/b12-11-,17-13+,19-14+,28-15-,29-16+,30-18+,31-20+ |
| InChIKey | BNDHJHDWBOVXQE-INYJMGAFSA-N |
| Literature Reference | A. Khare, G.P. Moss, B.C. Weedon, J. Chem. Soc. Perkin I 1389 (1988). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |