Spektraris NMR
(4S)-3,4beta,8beta-Trihydroxy-6,6,8-trimethyl-1,3,4,4abeta,5,6,8,9-octahydroazuleno[5,6-c]furan-1-one
![(4S)-3,4beta,8beta-Trihydroxy-6,6,8-trimethyl-1,3,4,4abeta,5,6,8,9-octahydroazuleno[5,6-c]furan-1-one](/nmr/static/nmr/svg/21521.svg)
Common Name: (4S)-3,4beta,8beta-Trihydroxy-6,6,8-trimethyl-1,3,4,4abeta,5,6,8,9-octahydroazuleno[5,6-c]furan-1-one
Synonyms: (4S)-3,4beta,8beta-Trihydroxy-6,6,8-trimethyl-1,3,4,4abeta,5,6,8,9-octahydroazuleno[5,6-c]furan-1-one
CAS Registry Number:
InChI: InChI=1S/C15H20O5/c1-14(2)4-7-9(6-14)15(3,19)5-8-10(11(7)16)13(18)20-12(8)17/h6-7,11,13,16,18-19H,4-5H2,1-3H3/t7-,11+,13?,15+/m1/s1
InChIKey: InChIKey=DMFMLSDQIFVNOX-UVZIMPLHSA-N
Formula: C15H20O5
Molecular Weight: 280.316878
Exact Mass: 280.131074
NMR Solvent: CD3C≡N
MHz:
Calibration:
NMR references: 13C - Kamo, T., Matsue, M., Kashiwabara, M., Hirota, M. Biosci Biotechnol Biochem (2006) 70, 2307-9
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Lactaranes; 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 (CH) | 138.1 |
| 2 (C) | 146.7 |
| 3 (C) | 70.6 |
| 4 (CH2) | 36 |
| 5 (C) | 171.7 |
| 6 (C) | 125.2 |
| 7 (C) | 161.5 |
| 8 (CH) | 71.6 |
| 9 (CH) | 51.2 |
| 10 (CH2) | 43.4 |
| 11 (C) | 41.9 |
| 12 (CH3) | 28.3 |
| 13 (CH3) | 29 |
| 14 (CH) | 96.6 |
| 15 (CH3) | 29 |
