Spektraris NMR
13-epi-homoverrucosan-6b-ol-5-one
Common Name: 13-epi-homoverrucosan-6b-ol-5-one
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H32O2/c1-12(2)14-6-7-19(4)8-9-20(5)15(17(14)19)10-13(3)11-16(21)18(20)22/h10,12,14-15,17-18,22H,6-9,11H2,1-5H3/t14-,15-,17-,18+,19-,20-/m1/s1
InChIKey: InChIKey=BBACBOTVROAZEO-BRGLROSXSA-N
Formula: C20H32O2
Molecular Weight: 304.467632
Exact Mass: 304.24023
NMR Solvent: CDCl3
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) | 40.3 |
| 2 (CH) | 130.5 |
| 3 (C) | 128.3 |
| 4 (CH2) | 46.1 |
| 5 (C) | 211 |
| 6 (CH) | 84.2 |
| 7 (C) | 48.6 |
| 8 (CH2) | 27.8 |
| 9 (CH2) | 36.5 |
| 10 (C) | 41.4 |
| 11 (CH2) | 40.5 |
| 12 (CH2) | 27.7 |
| 13 (CH) | 44.8 |
| 14 (CH) | 49.4 |
| 15 (CH) | 30.1 |
| 16 (CH3) | 21.3 |
| 17 (CH3) | 23.4 |
| 18 (CH3) | 23.9 |
| 19 (CH3) | 18.2 |
| 20 (CH3) | 19.8 |
