Spektraris NMR
4''-hidroxyaporpinone A
Common Name: 4''-hidroxyaporpinone A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C11H12O5/c1-11(15,7-13)5-4-8(6-12)9-2-3-10(14)16-9/h2-3,12-13,15H,6-7H2,1H3/b9-8+
InChIKey: InChIKey=OPUNBWBQUCHJGF-CMDGGOBGSA-N
Formula: C11H12O5
Molecular Weight: 224.210409
Exact Mass: 224.068473
NMR Solvent: C+M
MHz:
Calibration:
NMR references: 13C - M., Wright J.E., Seldes A.M Phytochemistry (2003) 62, 239-43
Species:
Notes: Family : Miscellanea, Type : Butanolides; 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 |
|---|---|
| 2 (C) | 169.1 |
| 3 (CH) | 120 |
| 4 (CH) | 139.9 |
| 5 (C) | 153.6 |
| 1' (C) | 108.9 |
| 2' (C) | 78.6 |
| 3' (C) | 104.6 |
| 4' (C) | 68.8 |
| 5' (CH2) | 70 |
| 6' (CH3) | 25 |
| 1'' (CH2) | 59.7 |
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