Spektraris NMR
6b,8b,10b-Trihydroxy-3-oxoeremophilenolide
Common Name: 6b,8b,10b-Trihydroxy-3-oxoeremophilenolide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H20O6/c1-7-10-11(17)13(3)8(2)9(16)4-5-14(13,19)6-15(10,20)21-12(7)18/h8,11,17,19-20H,4-6H2,1-3H3/t8-,11+,13-,14-,15-/m0/s1
InChIKey: InChIKey=FSMDVLKFWUQOFJ-QNBYZYIZSA-N
Formula: C15H20O6
Molecular Weight: 296.316283
Exact Mass: 296.125988
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Mao, M., Yang, Z., Jia, Z. Planta Med (2003) 69, 745-9
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eremophilanes; 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 (CH2) | 34.2 |
| 2 (CH2) | 37.4 |
| 3 (C) | 208.9 |
| 4 (CH) | 46.9 |
| 5 (C) | 49.5 |
| 6 (CH) | 70.2 |
| 7 (C) | 150.9 |
| 8 (C) | 103.1 |
| 9 (CH2) | 43.1 |
| 10 (C) | 73.2 |
| 11 (C) | 129.4 |
| 12 (C) | 170 |
| 13 (CH3) | 8.5 |
| 14 (CH3) | 11.9 |
| 15 (CH3) | 12.8 |
