Spektraris NMR
Psiadin
Common Name: Psiadin
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H30O3/c1-13-7-19-6-5-17-18(2,16(19)4-3-14(13)8-19)9-15(23)10-20(17,11-21)12-22/h14,16-17,21-22H,1,3-12H2,2H3/t14-,16+,17+,18+,19-/m1/s1
InChIKey: InChIKey=IGOMNRZBTQVLBU-VINWQNLFSA-N
Formula: C20H30O3
Molecular Weight: 318.451155
Exact Mass: 318.219495
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Midiwo, J.O., Owuor, F.A.O., Juma, B.F., Waterman, P.G. Phytochemistry (1997) 45, 117-20
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Kauranes; 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) | 56.6 |
| 2 (C) | 215.6 |
| 3 (CH2) | 45.7 |
| 4 (C) | 48.5 |
| 5 (CH) | 48.4 |
| 6 (CH2) | 21.4 |
| 7 (CH2) | 41.4 |
| 8 (C) | 44.8 |
| 9 (CH) | 55.3 |
| 10 (C) | 44 |
| 11 (CH2) | 19.1 |
| 12 (CH2) | 33.5 |
| 13 (CH) | 44.6 |
| 14 (CH2) | 39.8 |
| 15 (CH2) | 49.5 |
| 16 (C) | 155.9 |
| 17 (CH2) | 104.2 |
| 18 (CH2) | 67.4 |
| 19 (CH2) | 64.2 |
| 20 (CH3) | 20 |
