Spektraris NMR
13-epi-homoverrucosan-5b,6b,8b-triol
Common Name: 13-epi-homoverrucosan-5b,6b,8b-triol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H34O3/c1-11(2)13-6-7-19(4)10-16(22)20(5)14(17(13)19)8-12(3)9-15(21)18(20)23/h8,11,13-18,21-23H,6-7,9-10H2,1-5H3/t13-,14-,15+,16-,17-,18+,19-,20+/m1/s1
InChIKey: InChIKey=YHPDOQAJSNXLDF-OOPRVSQSSA-N
Formula: C20H34O3
Molecular Weight: 322.482918
Exact Mass: 322.250795
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Valcic, S., Huch, V., Veith, M., Becker, H. Phytochemistry (1995) 40, 199-203
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Homoverrucosanes; 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) | 32.1 |
| 2 (CH) | 132.6 |
| 3 (C) | 132.1 |
| 4 (CH2) | 42 |
| 5 (CH) | 67.7 |
| 6 (CH) | 83.5 |
| 7 (C) | 45.4 |
| 8 (CH) | 80.3 |
| 9 (CH2) | 45.3 |
| 10 (C) | 40.3 |
| 11 (CH2) | 36.1 |
| 12 (CH2) | 25.7 |
| 13 (CH) | 45.6 |
| 14 (CH) | 52.7 |
| 15 (CH) | 30.8 |
| 16 (CH3) | 22.2 |
| 17 (CH3) | 23.1 |
| 18 (CH3) | 26.4 |
| 19 (CH3) | 19.7 |
| 20 (CH3) | 24.3 |
