Botryenalol

Botryenalol

Common Name: Botryenalol

Synonyms: Botryenalol

CAS Registry Number:

InChI: InChI=1S/C17H26O4/c1-10-6-13(21-11(2)20)15-14(12(10)7-18)17(5,9-19)8-16(15,3)4/h7,10,13,15,19H,6,8-9H2,1-5H3/t10-,13+,15-,17-/m1/s1

InChIKey: InChIKey=DSVSTMJOGQEZJX-BYLNDYCFSA-N

Formula: C17H26O4

Molecular Weight: 294.38659

Exact Mass: 294.183109

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Collado, I.G., Aleu, J., Hernandez-Galan, R., Duran-Patron, R., Curr Org Chem (2000) 4, 1261-86

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Botryanes; 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) 131.1
2 (CH) 29.1
3 (CH2) 36.7
4 (CH) 71.7
5 (CH) 58.4
6 (C) 39.1
7 (CH2) 54.1
8 (C) 51.8
9 (C) 162.8
10 (CH) 192.4
11 (CH3) 20.8
12 (CH3) 29.6
13 (CH3) 23.6
14 (CH3) 28.9
15 (CH2) 70.3
4a (C) 179.5
4b (CH3) 21.3