Spektraris NMR
Picealactone A
Common Name: Picealactone A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H22O3/c1-11(2)12-6-7-14-13(10-12)15(21)16-17-19(14,3)8-5-9-20(17,4)18(22)23-16/h6-7,10-11H,5,8-9H2,1-4H3/t19-,20-/m1/s1
InChIKey: InChIKey=UKOKENMLXFNPEJ-WOJBJXKFSA-N
Formula: C20H22O3
Molecular Weight: 310.387629
Exact Mass: 310.156895
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - uo, Y.H., Yeh, M.H., Lin, H.C. Chem Pharm Bull (2004) 52, 861-3
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Abietanes; 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) | 42.4 |
| 2 (CH2) | 19 |
| 3 (CH2) | 36 |
| 4 (C) | 47.1 |
| 5 (C) | 145.5 |
| 6 (C) | 142.5 |
| 7 (C) | 173.9 |
| 8 (C) | 130.8 |
| 9 (C) | 148.4 |
| 10 (C) | 38.9 |
| 11 (CH) | 128.5 |
| 12 (CH) | 131.6 |
| 13 (C) | 148.1 |
| 14 (CH) | 124.7 |
| 15 (CH) | 33.8 |
| 16 (CH3) | 23.7 |
| 17 (CH3) | 23.7 |
| 18 (C) | 179.5 |
| 19 (CH3) | 21.1 |
| 20 (CH3) | 24.4 |
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The Spektraris NMR database is developed and hosted by the Lange laboratory at WSU. CAS Registry Number is a Registered Trademark of the American Chemical Society.