Spektraris NMR
(3R,4S,5R,7S,9R)-3,9-Dihydroxysolavetivone
Common Name: (3R,4S,5R,7S,9R)-3,9-Dihydroxysolavetivone
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H22O3/c1-8(2)11-6-13(17)15(7-11)9(3)5-12(16)14(18)10(15)4/h5,10-11,13-14,17-18H,1,6-7H2,2-4H3/t10-,11-,13-,14-,15+/m1/s1
InChIKey: InChIKey=BLDKDCBSDHBTFV-BBIZWXPBSA-N
Formula: C15H22O3
Molecular Weight: 250.33395
Exact Mass: 250.156895
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - rakawa, T., Mikami, Y., Yoshida, K., Kawahar, N., Hayashi, T., Ishimaru, H. J Nat Prod (1998) 61, 1516-9
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Spirovetivanes; 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) | 125.1 |
| 2 (C) | 200.4 |
| 3 (CH) | 73.7 |
| 4 (CH) | 48.4 |
| 5 (C) | 55.8 |
| 6 (CH2) | 40.8 |
| 7 (CH) | 42.7 |
| 8 (CH2) | 40.5 |
| 9 (CH) | 80.8 |
| 10 (C) | 168.6 |
| 11 (C) | 147.9 |
| 12 (CH3) | 21.3 |
| 13 (CH2) | 108.9 |
| 14 (CH3) | 21.4 |
| 15 (CH3) | 13.7 |
