Spektraris NMR
16-Hydroxy-19-oxomanoyl oxide
Common Name: 16-Hydroxy-19-oxomanoyl oxide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H32O3/c1-5-20(14-22)12-8-16-18(3)10-6-9-17(2,13-21)15(18)7-11-19(16,4)23-20/h5,13,15-16,22H,1,6-12,14H2,2-4H3/t15-,16-,17+,18-,19+,20-/m0/s1
InChIKey: InChIKey=WOLYTRXQEBGVJK-GXUNQHPWSA-N
Formula: C20H32O3
Molecular Weight: 320.467037
Exact Mass: 320.235145
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Li, Y.C., Kuo, Y.H. J Nat Prod (1998) 61, 997-1000
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Labdanes; 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) | 38.3 |
| 2 (CH2) | 18.3 |
| 3 (CH2) | 34.3 |
| 4 (C) | 48.3 |
| 5 (CH) | 56.7 |
| 6 (CH2) | 19.8 |
| 7 (CH2) | 43.5 |
| 8 (C) | 75 |
| 9 (CH) | 51.5 |
| 10 (C) | 37.6 |
| 11 (CH2) | 14.7 |
| 12 (CH2) | 26.8 |
| 13 (C) | 76.7 |
| 14 (CH) | 143.8 |
| 15 (CH2) | 114.2 |
| 16 (CH2) | 68.6 |
| 17 (CH3) | 25.7 |
| 18 (CH3) | 24.1 |
| 19 (CH) | 205.4 |
| 20 (CH3) | 13.9 |
