13-Noreudesma-1,4(15)-dien-11-yn-3-one

13-Noreudesma-1,4(15)-dien-11-yn-3-one

Common Name: 13-Noreudesma-1,4(15)-dien-11-yn-3-one

Synonyms: 13-Noreudesma-1,4(15)-dien-11-yn-3-one

CAS Registry Number:

InChI: InChI=1S/C14H16O/c1-4-11-5-7-14(3)8-6-13(15)10(2)12(14)9-11/h1,6,8,11-12H,2,5,7,9H2,3H3/t11-,12+,14+/m1/s1

InChIKey: InChIKey=IGGHNQBLFKBHMD-DYEKYZERSA-N

Formula: C14H16O1

Molecular Weight: 200.27676

Exact Mass: 200.120115

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Higuchi, Y., Shimoma, F., Koyanagi, R., Suda, K., Mitsui, T., Kataoka, T., Nagai, K., Ando, M. J Nat Prod (2003) 66, 588-94

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eudesmanes; 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) 160.9
2 (CH) 127
3 (C) 189
4 (C) 145.1
5 (CH) 47.4
6 (CH2) 29.9
7 (CH) 28.9
8 (CH2) 27.9
9 (CH2) 36.3
10 (C) 37.2
11 (C) 87.6
12 (CH) 68.4
14 (CH3) 17.7
15 (CH2) 118.5