Spektraris NMR
Sarsolenone
Common Name: Sarsolenone
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H30O5/c1-13(2)22(25)11-8-16-18(24)9-10-21(5)19(26-15(4)23)7-6-14(3)12-17(22)20(16)27-21/h12,17,19,25H,1,6-11H2,2-5H3/b14-12-/t17-,19-,21+,22-/m0/s1
InChIKey: InChIKey=RWBIECFPGSVNFV-KEVBLHMXSA-N
Formula: C22H30O5
Molecular Weight: 374.471437
Exact Mass: 374.209324
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Zhang, M. J Nat Prod (1995) 58, 414-8
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Miscellanea; 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) | 75 |
| 2 (CH) | 47.6 |
| 3 (CH) | 123.3 |
| 4 (C) | 147.7 |
| 5 (CH2) | 29 |
| 6 (CH2) | 26.5 |
| 7 (CH) | 75.7 |
| 8 (C) | 84.7 |
| 9 (CH2) | 33.2 |
| 10 (CH2) | 38 |
| 11 (C) | 200.1 |
| 12 (C) | 117.1 |
| 13 (CH2) | 20.6 |
| 14 (CH2) | 26 |
| 15 (C) | 137.7 |
| 16 (CH2) | 112.2 |
| 17 (CH3) | 17.8 |
| 18 (CH3) | 22.7 |
| 19 (CH3) | 20.2 |
| 20 (C) | 163.6 |
| 7a (C) | 169.8 |
| 7b (CH3) | 21 |
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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.