Spektraris NMR
7a,9b,18-Trihydroxy-ent-kaur-16-ene
Common Name: 7a,9b,18-Trihydroxy-ent-kaur-16-ene
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H32O3/c1-13-10-19-11-14(13)5-8-20(19,23)18(3)7-4-6-17(2,12-21)15(18)9-16(19)22/h14-16,21-23H,1,4-12H2,2-3H3/t14-,15-,16-,17-,18-,19-,20-/m1/s1
InChIKey: InChIKey=XWHDYPNTMZDVJN-BQTQRSMXSA-N
Formula: C20H32O3
Molecular Weight: 320.467037
Exact Mass: 320.235145
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Fraga B.M., Alvarez L., Suarez S. J Nat Prod (2003) 66, 327-31
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Kauranes; 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) | 31.9 |
| 2 (CH2) | 17.8 |
| 3 (CH2) | 34.7 |
| 4 (C) | 37.5 |
| 5 (CH) | 38.8 |
| 6 (CH2) | 29.4 |
| 7 (CH) | 70.5 |
| 8 (C) | 54.6 |
| 9 (C) | 78.5 |
| 10 (C) | 43.7 |
| 11 (CH2) | 30.9 |
| 12 (CH2) | 34.1 |
| 13 (CH) | 41.6 |
| 14 (CH2) | 30 |
| 15 (CH2) | 37.3 |
| 16 (C) | 154.6 |
| 17 (CH2) | 103.4 |
| 18 (CH2) | 71.9 |
| 19 (CH3) | 17.6 |
| 20 (CH3) | 19.7 |
