Spektraris NMR
ent-17-Hydroxy- 15-oxokauran-19-oic acid
Common Name: ent-17-Hydroxy- 15-oxokauran-19-oic acid
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H30O4/c1-18-7-3-8-19(2,17(23)24)14(18)6-9-20-10-12(4-5-15(18)20)13(11-21)16(20)22/h12-15,21H,3-11H2,1-2H3,(H,23,24)/t12-,13-,14+,15+,18-,19-,20-/m1/s1
InChIKey: InChIKey=FQPNYDARJNLLHJ-SROPKWAUSA-N
Formula: C20H30O4
Molecular Weight: 334.45056
Exact Mass: 334.214409
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Deoliveira, A.B., Hanson, J.R., Takahashi, J.A. Phytochemistry (1995) 40, 439.42
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) | 39.6 |
| 2 (CH2) | 18.7 |
| 3 (CH2) | 37.6 |
| 4 (C) | 43.6 |
| 5 (CH) | 55.9 |
| 6 (CH2) | 20.1 |
| 7 (CH2) | 33.9 |
| 8 (C) | 53.4 |
| 9 (CH) | 51.5 |
| 10 (C) | 39.9 |
| 11 (CH2) | 18.5 |
| 12 (CH2) | 25.3 |
| 13 (CH) | 32.9 |
| 14 (CH2) | 37.4 |
| 15 (C) | 225.6 |
| 16 (CH) | 54.6 |
| 17 (CH2) | 60.6 |
| 18 (CH3) | 28.9 |
| 19 (C) | 183.1 |
| 20 (CH3) | 15.5 |
