Spektraris NMR
Litseahumulane A
Common Name: Litseahumulane A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H24O2/c1-11-5-7-13(16)12(2)6-8-14(17)15(3,4)10-9-11/h9-11,14,17H,2,5-8H2,1,3-4H3/b10-9+/t11-,14+/m1/s1
InChIKey: InChIKey=SSWUIXHLQYARRL-FAYXPKFJSA-N
Formula: C15H24O2
Molecular Weight: 236.350426
Exact Mass: 236.17763
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Zhang, H.J., Tan, G.T., Santarsiero, B.D., Mesecar, A.D., Hung, N.V., Cuong, N.M., Doel Soejarto, D., Pezzuto, J.M., Fong, H.H. J Nat Prod (2003) 66, 609-15
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Humulanes; 13 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) | 136.8 |
| 2 (CH) | 134.6 |
| 3 (CH) | 36.4 |
| 4 (CH2) | 33.3 |
| 5 (CH2) | 36 |
| 6 (C) | 203.6 |
| 7 (C) | 149.8 |
| 8 (CH2) | 31.2 |
| 9 (CH2) | 30.3 |
| 10 (CH) | 78.5 |
| 11 (C) | 40.2 |
| 12 (CH3) | 19.3 |
| 13 (CH3) | 26.2 |
| 14 (CH2) | 123.9 |
| 15 (CH3) | 20.6 |
