Spektraris NMR
12A-Hydroxy-13-epi-manoyloxide
Common Name: 12A-Hydroxy-13-epi-manoyloxide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H34O2/c1-7-19(5)16(21)13-15-18(4)11-8-10-17(2,3)14(18)9-12-20(15,6)22-19/h7,14-16,21H,1,8-13H2,2-6H3/t14-,15?,16-,18-,19+,20+/m0/s1
InChIKey: InChIKey=MIZHVKCAJCIZAG-ODCZVXNPSA-N
Formula: C20H34O2
Molecular Weight: 306.483513
Exact Mass: 306.25588
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Zhou, L., Fuentes, E.R., Hoffmann, J.J., Timmermann, B.N. Phytochemistry (1995) 40, 1201-7
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) | 39 |
| 2 (CH2) | 18.5 |
| 3 (CH2) | 42.1 |
| 4 (C) | 33.3 |
| 5 (CH) | 56.6 |
| 6 (CH2) | 20 |
| 7 (CH2) | 42.8 |
| 8 (C) | 76 |
| 9 (CH) | 49.8 |
| 10 (C) | 36.4 |
| 11 (CH2) | 23.6 |
| 12 (CH) | 69.2 |
| 13 (C) | 76.1 |
| 14 (CH) | 47.2 |
| 15 (CH2) | 110.6 |
| 16 (CH3) | 26.9 |
| 17 (CH3) | 24.3 |
| 18 (CH3) | 33.3 |
| 19 (CH3) | 21.2 |
| 20 (CH3) | 15.8 |
