Table 1.
13C-NMR (125 MHz) and 1H-NMR (500 MHz) data (CDCl3) of roretziaxanthin (1).
| Position | 13C-NMR | 1H-NMR | Position | 13C-NMR | 1H-NMR | ||
|---|---|---|---|---|---|---|---|
| δ | δ | Mult.J (Hz) | δ | δ | Mult.J (Hz) | ||
| 1 | 36.80 | dd (13.5, 13.5) | 1’ | 146.0 | |||
| 2 | 45.38 | 1.81 | dd (13.5, 5.5) | 2’ | 46.23 | 3.78 | d (7.5) |
| 2.15 | ddd (13.5, 5.5, 2.0) | ||||||
| 3 | 69.19 | 4.32 | 3’ | 41.46 | 2.20 | dd (18.5, 2.0) | |
| 2.71 | dd (18.5, 7.5) | ||||||
| 4 | 200.42 | 4’ | 207.79 | ||||
| 5 | 126.78 | 5’ | 136.92 | ||||
| 6 | 162.25 | 6’ | 164.60 | ||||
| 7 | 123.33 | 6.22 | d (16.0) | 7’ | 120.59 | 6.62 | d (15.5) |
| 8 | 142.35 | 6.43 | d (16.0) | 8’ | 141.39 | 6.95 | d (15.5) |
| 9 | 134.66 | 9’ | 135.25 | ||||
| 10 | 135.16 | 6.31 | d (11.0) | 10’ | 137.51 | 6.37 | d (11.5) |
| 11 | 124.73 | 6.69~6.63 | overlapped | 11’ | 124.73 | 6.69~6.63 | overlapped |
| 12 | 139.67 | 6.45 | d (15.5) | 12’ | 140.49 | 6.49 | d (11.5) |
| 13 | 136.78 | 13’ | 136.92 | ||||
| 14 | 133.81 | 6.33~6.31 | overlapped | 14’ | 134.34 | 6.33~6.31 | overlapped |
| 15 | 130.65 | 6.69~6.63 | overlapped | 15’ | 130.95 | 6.69~6.63 | overlapped |
| 16 | 29.15 | 1.32 | s | 16’ | 112.90 | 4.88 | t (2.0) |
| 4.95 | s | ||||||
| 17 | 30.75 | 1.21 | s | 17’ | 18.08 | 1.52 | s |
| 18 | 14.04 | 1.95 | s | 18’ | 8.40 | 1.88 | d (2.0) |
| 19 | 12.85 | 2.01 | s | 19’ | 2.48/12.81 | 2.00/2.01 | s |
| 20 | 12.59 | 1.99 | s | 20’ | 2.48/12.81 | 2.00/2.01 | s |
| OH | 3.69 | d (2.0) |
Multiplicity: s: singlet, d: doublet, q: quartet, m: multiplet. 1H- and 13C-NMR signals of 19′ and 20′ are indistinguishable.