Spektraris NMR
7-Hydroxyerogorgiaene
Common Name: 7-Hydroxyerogorgiaene
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H30O/c1-13(2)7-6-8-14(3)17-10-9-15(4)18-12-20(21)16(5)11-19(17)18/h7,11-12,14-15,17,21H,6,8-10H2,1-5H3/t14-,15+,17-/m1/s1
InChIKey: InChIKey=HWRNTAPYVJUXEL-HLLBOEOZSA-N
Formula: C20H30O1
Molecular Weight: 286.452345
Exact Mass: 286.229666
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Rodriguez, A.D., Ramirez, C. J Nat Prod (2001) 64, 100-2
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Serrulatanes; 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) | 32.9 |
| 2 (CH2) | 31.8 |
| 3 (CH2) | 21.6 |
| 4 (CH) | 40.8 |
| 5 (CH) | 129.9 |
| 6 (C) | 120.7 |
| 7 (C) | 151.2 |
| 8 (CH) | 112.7 |
| 9 (C) | 142.4 |
| 10 (C) | 132.2 |
| 11 (CH) | 36.9 |
| 12 (CH2) | 35.2 |
| 13 (CH2) | 26.3 |
| 14 (CH) | 124.9 |
| 15 (C) | 131.2 |
| 16 (CH3) | 25.8 |
| 17 (CH3) | 17.7 |
| 18 (CH3) | 14.4 |
| 19 (CH3) | 15.5 |
| 20 (CH3) | 21.8 |
