Spektraris NMR
Hebeiabinin C
Common Name: Hebeiabinin C
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H28O3/c1-12-10-23-18-13(12)4-6-15-14(18)5-7-16-19(15,2)9-8-17(22)20(16,3)11-21/h5,11,13,15-18,22H,1,4,6-10H2,2-3H3/t13-,15+,16-,17+,18+,19-,20+/m0/s1
InChIKey: InChIKey=RDLMTYSAUFHVIZ-UFANPLCHSA-N
Formula: C20H28O3
Molecular Weight: 316.435274
Exact Mass: 316.203845
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Huang, S.X., Pu, J.X., Xiao, W.L., Li, L.M., Weng, Z.Y., Zhou, Y., Han, Q.B., Peng, S.L., Ding, L.S., Lou, L.G., Sun, H.D. Phytochemistry (2007) 68, 616-22
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Abietanes; 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) | 37.6 |
| 2 (CH2) | 27.3 |
| 3 (CH) | 72.3 |
| 4 (C) | 55.7 |
| 5 (CH) | 41.5 |
| 6 (CH2) | 25 |
| 7 (CH) | 128.6 |
| 8 (C) | 135.6 |
| 9 (CH) | 49.2 |
| 10 (C) | 34.2 |
| 11 (CH2) | 24 |
| 12 (CH2) | 29 |
| 13 (CH) | 46 |
| 14 (CH) | 83.5 |
| 15 (C) | 154.7 |
| 16 (CH2) | 69.7 |
| 17 (CH2) | 103.3 |
| 18 (CH) | 206.5 |
| 19 (CH3) | 9.5 |
| 20 (CH3) | 15 |
