Spektraris NMR
3β,6β-dihydroxysclareolide
Common Name: 3β,6β-dihydroxysclareolide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C16H26O4/c1-14(2)11(18)5-6-15(3)10-7-12(19)20-16(10,4)8-9(17)13(14)15/h9-11,13,17-18H,5-8H2,1-4H3/t9-,10-,11+,13+,15-,16-/m1/s1
InChIKey: InChIKey=VRERGTWHBMDBLY-FKQMCSFVSA-N
Formula: C16H26O4
Molecular Weight: 282.375854
Exact Mass: 282.183109
NMR Solvent: CDDl3 + DMSO-d6
MHz:
Calibration:
NMR references: 13C - Hanson, J.R., Truneh, A. Phytochemistry (1996) 42, 1021-3
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Labdanes; 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) | 39.3 |
| 2 (CH2) | 26.4 |
| 3 (CH) | 78.7 |
| 4 (C) | 39.4 |
| 5 (CH) | 56.9 |
| 6 (CH) | 67.7 |
| 7 (CH2) | 46.4 |
| 8 (C) | 86.4 |
| 9 (CH) | 59.4 |
| 10 (C) | 35.6 |
| 11 (CH2) | 28.7 |
| 12 (C) | 177.4 |
| 17 (CH3) | 22.3 |
| 18 (CH3) | 26.8 |
| 19 (CH3) | 16.3 |
| 20 (CH3) | 16 |
