Spektraris NMR
7-Hydroxy-10-methoxydeacetyldihydrobotrydial
Common Name: 7-Hydroxy-10-methoxydeacetyldihydrobotrydial
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C16H28O5/c1-8-6-9(17)11-14(2,3)13(18)15(4)7-21-12(20-5)10(8)16(11,15)19/h8-13,17-19H,6-7H2,1-5H3/t8-,9+,10-,11+,12+,13-,15+,16-/m1/s1
InChIKey: InChIKey=YZXINJQTAMWFKM-GUWPTFDSSA-N
Formula: C16H28O5
Molecular Weight: 300.39114
Exact Mass: 300.193674
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 (CH) | 55.4 |
| 2 (CH) | 28.7 |
| 3 (CH2) | 44.3 |
| 4 (CH) | 68.9 |
| 5 (CH) | 62.7 |
| 6 (C) | 41.2 |
| 7 (CH) | 82 |
| 8 (C) | 48 |
| 9 (C) | 79.3 |
| 10 (CH) | 99.1 |
| 11 (CH3) | 19.4 |
| 12 (CH3) | 19.5 |
| 13 (CH3) | 33.6 |
| 14 (CH3) | 16 |
| 15 (CH2) | 66.5 |
| 10a (CH3) | 54.1 |
