Spektraris NMR
ent-kaur-16-en-13,19-diol
Common Name: ent-kaur-16-en-13,19-diol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H32O2/c1-14-11-19-9-5-15-17(2,13-21)7-4-8-18(15,3)16(19)6-10-20(14,22)12-19/h15-16,21-22H,1,4-13H2,2-3H3/t15-,16+,17+,18-,19-,20?/m1/s1
InChIKey: InChIKey=DMNRMQZQSQMOKH-WENZLKBRSA-N
Formula: C20H32O2
Molecular Weight: 304.467632
Exact Mass: 304.24023
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Subrahmanyam, C., Rao, B.V., Ward, R.S., Hursthouse, M.B., Hibbs, D.E. Phytochemistry (1999) 51, 83-90
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) | 40.6 |
| 2 (CH2) | 20.5 |
| 3 (CH2) | 36.1 |
| 4 (C) | 39.2 |
| 5 (CH) | 57 |
| 6 (CH2) | 20.7 |
| 7 (CH2) | 42.2 |
| 8 (C) | 41.7 |
| 9 (CH) | 55.2 |
| 10 (C) | 39.3 |
| 11 (CH2) | 18.7 |
| 12 (CH2) | 40.6 |
| 13 (C) | 79.8 |
| 14 (CH2) | 47.3 |
| 15 (CH2) | 48.2 |
| 16 (C) | 157.4 |
| 17 (CH2) | 102.9 |
| 18 (CH3) | 28 |
| 19 (CH2) | 64 |
| 20 (CH3) | 18.2 |
