(-)-9-Acetoxygymnomitr-8(12)-ene

(-)-9-Acetoxygymnomitr-8(12)-ene

Common Name: (-)-9-Acetoxygymnomitr-8(12)-ene

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C17H26O2/c1-11-13-9-15(3,10-14(11)19-12(2)18)17(5)8-6-7-16(13,17)4/h13-14H,1,6-10H2,2-5H3/t13-,14-,15+,16+,17-/m1/s1

InChIKey: InChIKey=PLOQFTYPCAOTDW-UHDSXZAQSA-N

Formula: C17H26O2

Molecular Weight: 262.38778

Exact Mass: 262.19328

NMR Solvent: C6D6

MHz:

Calibration:

NMR references: 13C - Adio, A.M., Paul, C., Konig, W.A., Muhle, H. Phytochemistry (2002) 61, 79-91

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Gymnomitranes; 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 (C) 45.2
2 (C) 55.8
3 (CH2) 36.3
4 (CH2) 27.7
5 (CH2) 37.7
6 (C) 54.8
7 (CH) 56.9
8 (C) 149.2
9 (CH) 70.4
10 (CH2) 45.4
11 (CH2) 47
12 (CH2) 107.6
13 (CH3) 24.1
14 (CH3) 23.3
15 (CH3) 27.7
9a (C) 170.1
9b (CH3) 20.6