Spektraris NMR
9-Hydroxy-3-epi-perforenone A
Common Name: 9-Hydroxy-3-epi-perforenone A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H22O3/c1-8-5-6-15(4)10(3)14(18)13(17)9(2)12(15)11(16)7-8/h5,10-11,14,16,18H,6-7H2,1-4H3/t10-,11+,14+,15+/m0/s1
InChIKey: InChIKey=STLDUPLKJSWMBL-RBDSIQFVSA-N
Formula: C15H22O3
Molecular Weight: 250.33395
Exact Mass: 250.156895
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Wright, A.D., Goclik, E., Konig, G.M. J Nat Prod (2003) 66, 435-7
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Perforanes; 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) | 128.6 |
| 2 (C) | 200.5 |
| 3 (CH) | 73.4 |
| 4 (CH) | 42 |
| 5 (C) | 45.1 |
| 6 (CH2) | 36.8 |
| 7 (CH) | 120.8 |
| 8 (C) | 135.4 |
| 9 (CH2) | 42.4 |
| 10 (CH) | 69 |
| 11 (C) | 165.2 |
| 12 (CH3) | 12.5 |
| 13 (CH3) | 10.2 |
| 14 (CH3) | 24.3 |
| 15 (CH3) | 26.1 |
