Spektraris NMR
Yunnancoronarin B
Common Name: Yunnancoronarin B
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H28O3/c1-13-12-16(21)17-19(2,3)9-5-10-20(17,4)15(13)7-6-14-8-11-23-18(14)22/h6-8,15-17,21H,1,5,9-12H2,2-4H3/b7-6+/t15-,16+,17-,20+/m0/s1
InChIKey: InChIKey=ALSRJBHEUPQISY-ITULZCSASA-N
Formula: C20H28O3
Molecular Weight: 316.435274
Exact Mass: 316.203845
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Zhao, Q., Qing, C., Hao, X.J., Han, J., Zuo, G.Y., Zou, C., Xu, G.L. Chem Pharm Bull (2008) 56, 210-2
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) | 43.7 |
| 2 (CH2) | 19.2 |
| 3 (CH2) | 44.1 |
| 4 (C) | 34.5 |
| 5 (CH) | 56.8 |
| 6 (CH) | 68.9 |
| 7 (CH2) | 46.5 |
| 8 (C) | 145.3 |
| 9 (CH) | 62.6 |
| 10 (C) | 40.3 |
| 11 (CH) | 135.9 |
| 12 (CH) | 121 |
| 13 (C) | 129.4 |
| 14 (CH) | 142.6 |
| 15 (CH2) | 69.5 |
| 16 (C) | 172.2 |
| 17 (CH2) | 111.8 |
| 18 (CH3) | 33.5 |
| 19 (CH3) | 23.8 |
| 20 (CH3) | 18 |
