12-Oxo-11-nordrim-8-en-14-oic Acid

12-Oxo-11-nordrim-8-en-14-oic Acid

Common Name: 12-Oxo-11-nordrim-8-en-14-oic Acid

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C14H20O3/c1-13-6-3-7-14(2,12(16)17)11(13)5-4-10(8-13)9-15/h8-9,11H,3-7H2,1-2H3,(H,16,17)/t11?,13-,14+/m1/s1

InChIKey: InChIKey=IFJPLGPKWWYSHR-WLPIGLKUSA-N

Formula: C14H20O3

Molecular Weight: 236.307332

Exact Mass: 236.141245

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Iwamoto, M., Ohtsu, H., Matsunaga, S., Tanaka, R. J Nat Prod (2000) 63, 1381-3

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Drimanes; 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) 38.4
2 (CH2) 19.1
3 (CH2) 37.7
4 (C) 43.6
5 (CH) 52.1
6 (CH2) 19.5
7 (CH2) 23.7
8 (C) 138.2
9 (CH) 160.9
10 (C) 37.4
12 (CH) 194.8
13 (CH3) 28.1
14 (C) 181.2
15 (CH3) 18.5