Spektraris NMR
ent-1?-hydroxy-7?-acetyl-15?,16?-epoxykaurane
Common Name: ent-1?-hydroxy-7?-acetyl-15?,16?-epoxykaurane
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H34O4/c1-12(23)25-17-10-15-19(2,3)9-8-16(24)20(15,4)14-7-6-13-11-22(14,17)18-21(13,5)26-18/h13-18,24H,6-11H2,1-5H3/t13-,14+,15-,16+,17+,18+,20+,21+,22-/m1/s1
InChIKey: InChIKey=DIGOIHGQCOCYOD-ZTIXDYSMSA-N
Formula: C22H34O4
Molecular Weight: 362.503795
Exact Mass: 362.24571
NMR Solvent:
MHz:
Calibration:
NMR references: 13C - Kilic, T. Molecules (2006) 11, 257-62
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 (CH) | 80.3 |
| 2 (CH2) | 29.2 |
| 3 (CH2) | 34.8 |
| 4 (C) | 37.6 |
| 5 (CH) | 34.8 |
| 6 (CH2) | 26.3 |
| 7 (CH) | 74.1 |
| 8 (C) | 48.3 |
| 9 (CH) | 45.9 |
| 10 (C) | 38.9 |
| 11 (CH2) | 17.3 |
| 12 (CH2) | 27.4 |
| 13 (CH) | 39.3 |
| 14 (CH2) | 31.2 |
| 15 (CH) | 62.4 |
| 16 (C) | 77.9 |
| 17 (CH3) | 17.9 |
| 18 (CH3) | 18.6 |
| 19 (CH3) | 17.5 |
| 20 (CH3) | 15.3 |
| 7a (C) | 178.6 |
| 7b (CH3) | 21.1 |
