Spektraris NMR
Polydactin B
Common Name: Polydactin B
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H26O2/c1-9(2)11-7-8-15(4)12(16)6-5-10(3)13(15)14(11)17/h9,11-14,16-17H,3,5-8H2,1-2,4H3/t11-,12-,13+,14-,15-/m0/s1
InChIKey: InChIKey=WKKJGHCXVKEJNU-RMEBNNNOSA-N
Formula: C15H26O2
Molecular Weight: 238.366308
Exact Mass: 238.19328
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Zhang, C.X., Zhu, C.C., Yan, S.J., Li, J., Su, J.Y., Liang, Y.J., Yang, X.P., Zheng, K.C., Zeng, L.M. J Asian Nat Prod Res (2008) 10, 277-80
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eudesmanes; 13 C Spectrum from Naproc 13: José Luis López-Pérez, Roberto Therón, Esther del Olmo, David Díaz: NAPROC-13: a database for the dereplication of natural product mixtures in bioassay-guided protocols. Bioinformatics 23(23):3256-3257 (2007)
Carbon NMR Peaks
| Position | PPM |
|---|---|
| 1 (CH) | 78.9 |
| 2 (CH2) | 31.8 |
| 3 (CH2) | 35 |
| 4 (C) | 146.1 |
| 5 (CH) | 55.7 |
| 6 (CH) | 67 |
| 7 (CH) | 49.2 |
| 8 (CH2) | 18 |
| 9 (CH2) | 36.2 |
| 10 (C) | 41.6 |
| 11 (CH) | 25.9 |
| 12 (CH3) | 16.1 |
| 13 (CH3) | 21 |
| 14 (CH3) | 11.5 |
| 15 (CH2) | 107.7 |
