Spektraris NMR
15-Hydroxydesacetylplectranthone
Common Name: 15-Hydroxydesacetylplectranthone
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C17H26O5/c1-10(2)14-4-5-17(9-19)7-13(21)6-12(8-18)15(17)16(14)22-11(3)20/h6,10,14-16,18-19H,4-5,7-9H2,1-3H3/t14-,15-,16+,17-/m0/s1
InChIKey: InChIKey=JBWXOPPLWIFVKF-NXOAAHMSSA-N
Formula: C17H26O5
Molecular Weight: 310.385994
Exact Mass: 310.178024
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Orabi, K.Y. J Nat Prod (2000) 63, 1709-11
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eudesmanes; 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) | 47.2 |
| 2 (C) | 199.8 |
| 3 (CH) | 125.5 |
| 4 (C) | 160.6 |
| 5 (CH) | 40.4 |
| 6 (CH) | 72.1 |
| 7 (CH) | 43.4 |
| 8 (CH2) | 21 |
| 9 (CH2) | 28.8 |
| 10 (C) | 40.7 |
| 11 (CH) | 29 |
| 12 (CH3) | 21.2 |
| 13 (CH3) | 21.1 |
| 14 (CH2) | 68.2 |
| 15 (CH2) | 64.6 |
| 6a (C) | 171.7 |
| 6b (CH3) | 21.7 |
