Spektraris NMR
7-Hydroxy-10-ethoxydehydrodihydrobotrydial
Common Name: 7-Hydroxy-10-ethoxydehydrodihydrobotrydial
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C17H24O3/c1-6-19-14-12-10(2)7-8-11-13(12)17(5,9-20-14)15(18)16(11,3)4/h7-8,14-15,18H,6,9H2,1-5H3/t14?,15-,17-/m1/s1
InChIKey: InChIKey=WVMUFKGZUAMWJW-HOSQGPGDSA-N
Formula: C17H24O3
Molecular Weight: 276.371303
Exact Mass: 276.172545
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Krohn, K., Dai, J., Florke, U., Aust, H.J., Drager, S., Schulz, B. J Nat Prod (2005) 68, 400-5
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Botryanes; 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 (C) | 134.5 |
| 2 (C) | 130.2 |
| 3 (CH) | 130.6 |
| 4 (CH) | 123.4 |
| 5 (C) | 144.7 |
| 6 (C) | 46 |
| 7 (CH) | 85.8 |
| 8 (C) | 44.1 |
| 9 (C) | 142.1 |
| 10 (CH) | 94.9 |
| 11 (CH3) | 19.1 |
| 12 (CH3) | 24.2 |
| 13 (CH3) | 29.4 |
| 14 (CH3) | 18.5 |
| 15 (CH2) | 69.3 |
| 10a (CH2) | 64.3 |
| 10b (CH3) | 15.7 |
