Spektraris NMR
(6ξ,7ξ,10ξ)-Aristolan-1-one
Common Name: (6ξ,7ξ,10ξ)-Aristolan-1-one
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H24O/c1-9-5-8-12(16)10-6-7-11-13(14(11,2)3)15(9,10)4/h9-11,13H,5-8H2,1-4H3/t9-,10-,11?,13?,15+/m0/s1
InChIKey: InChIKey=QNSSNXDKAPHGBZ-OUHOKRENSA-N
Formula: C15H24O1
Molecular Weight: 220.351021
Exact Mass: 220.182715
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Nagashima, F., Tamada, A., Fujii, N., Asakawa, Y. Phytochemistry (1997) 46, 1203-8
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Aristolanes; 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) | 217.1 |
| 2 (CH2) | 38.84 |
| 3 (CH2) | 28.8 |
| 4 (CH) | 31.3 |
| 5 (C) | 38.81 |
| 6 (CH) | 31.9 |
| 7 (CH) | 19.3 |
| 8 (CH2) | 20.3 |
| 9 (CH2) | 24.6 |
| 10 (CH) | 58.4 |
| 11 (C) | 18.8 |
| 12 (CH3) | 31.5 |
| 13 (CH3) | 17 |
| 14 (CH3) | 25.6 |
| 15 (CH3) | 16.2 |
