Parthenin

Parthenin

Common Name: Parthenin

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C15H18O3/c1-8-4-5-10-9(2)14(17)18-13(10)15(3)11(8)6-7-12(15)16/h6-8,10-11,13H,2,4-5H2,1,3H3/t8-,10-,11-,13+,15-/m0/s1

InChIKey: InChIKey=IFXGCKRDLITNAU-JHSUYXJUSA-N

Formula: C15H18O3

Molecular Weight: 246.302187

Exact Mass: 246.125594

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Ramesh, C., Ravindranath, N., Das, B., Prabhakar, A., Bharatam, J., Ravikumar, K., Kashinatham, A., McMorris, T.C. Phytochemistry (2003) 64, 841-4

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Guaianes; 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) 84.8
2 (CH) 163.4
3 (CH) 131.5
4 (C) 211.1
5 (C) 59.2
6 (CH) 78.8
7 (CH) 44.7
8 (CH2) 28.4
9 (CH2) 30.2
10 (CH) 40
11 (C) 140.5
12 (C) 170.8
13 (CH2) 121.6
14 (CH3) 17.7
15 (CH3) 18.2