Spektraris NMR
12α-hydroxyisosteviol
Common Name: 12α-hydroxyisosteviol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H30O4/c1-17-6-4-7-18(2,16(23)24)12(17)5-8-20-10-15(22)19(3,11-20)14(21)9-13(17)20/h12-14,21H,4-11H2,1-3H3,(H,23,24)/t12-,13-,14+,17+,18+,19+,20-/m0/s1
InChIKey: InChIKey=KHHQDXVAFQEBIY-WQMQNYNQSA-N
Formula: C20H30O4
Molecular Weight: 334.45056
Exact Mass: 334.214409
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - deOliveira, B.H., Strapasson, R.A. Phytochemistry (1996) 43, 393-5
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Beyeranes; 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) | 40.73 |
| 2 (CH2) | 20.01 |
| 3 (CH2) | 39.06 |
| 4 (C) | 44.65 |
| 5 (CH) | 58.19 |
| 6 (CH2) | 22.89 |
| 7 (CH2) | 42.04 |
| 8 (C) | 41.21 |
| 9 (CH) | 50.7 |
| 10 (C) | 38.84 |
| 11 (CH2) | 29.97 |
| 12 (CH) | 72.05 |
| 13 (C) | 55.67 |
| 14 (CH2) | 48.14 |
| 15 (CH2) | 48.25 |
| 16 (C) | 223.13 |
| 17 (CH3) | 17.51 |
| 18 (CH3) | 29.48 |
| 19 (C) | 181.59 |
| 20 (CH3) | 13.47 |
