Spektraris NMR
5αH-2β,4-Epoxy-3β-hydroxyguaia-1(10),11(13)-dien-6β12-olide (moroccolide A)
Common Name: 5αH-2β,4-Epoxy-3β-hydroxyguaia-1(10),11(13)-dien-6β12-olide (moroccolide A)
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H18O4/c1-6-4-5-8-7(2)14(17)18-11(8)10-9(6)12-13(16)15(10,3)19-12/h8,10-13,16H,2,4-5H2,1,3H3/t8-,10-,11+,12-,13-,15-/m0/s1
InChIKey: InChIKey=YTVDEYRARRBPLE-BXJASZPBSA-N
Formula: C15H18O4
Molecular Weight: 262.301592
Exact Mass: 262.120509
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Hilmi, F., Sticher, O., Heilmann, J. J Nat Prod (2002) 65, 523-6
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Guaianes; 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) | 136.9 |
| 2 (CH) | 68.4 |
| 3 (CH) | 73.2 |
| 4 (C) | 65.4 |
| 5 (CH) | 53.5 |
| 6 (CH) | 83 |
| 7 (CH) | 55.3 |
| 8 (CH2) | 26.2 |
| 9 (CH2) | 35.8 |
| 10 (C) | 142.3 |
| 11 (C) | 141.2 |
| 12 (C) | 167 |
| 13 (CH2) | 118.2 |
| 14 (CH3) | 22.3 |
| 15 (CH3) | 19.8 |
