Spektraris NMR
(11S)-11,18-Dihydroxysclareol
Common Name: (11S)-11,18-Dihydroxysclareol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H36O4/c1-6-18(3,23)12-14(22)16-19(4)10-7-9-17(2,13-21)15(19)8-11-20(16,5)24/h6,14-16,21-24H,1,7-13H2,2-5H3/t14-,15-,16+,17-,18-,19-,20+/m0/s1
InChIKey: InChIKey=IHAWFGMLUNAMPD-UZEMSBSCSA-N
Formula: C20H36O4
Molecular Weight: 340.498205
Exact Mass: 340.26136
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Choudhary, M.I., Siddiqui, Z.A., Hussain, S. Chem Biodivers (2006) 3, 54-61
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) | 39.2 |
| 2 (CH2) | 19.1 |
| 3 (CH2) | 35.2 |
| 4 (C) | 38.6 |
| 5 (CH) | 52.2 |
| 6 (CH2) | 20.2 |
| 7 (CH2) | 44.1 |
| 8 (C) | 74.9 |
| 9 (CH) | 64.6 |
| 10 (C) | 37.3 |
| 11 (CH) | 70.5 |
| 12 (CH2) | 49.2 |
| 13 (C) | 73.6 |
| 14 (CH) | 144.7 |
| 15 (CH2) | 111.3 |
| 16 (CH3) | 27.5 |
| 17 (CH3) | 15.7 |
| 18 (CH2) | 72.1 |
| 19 (CH3) | 17.3 |
| 20 (CH3) | 24.2 |
