Hyrtiophenol

Hyrtiophenol

Common Name: Hyrtiophenol

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C23H32O3/c1-15-7-6-8-20-22(15,3)12-11-16(2)23(20,4)14-18-13-17(21(25)26-5)9-10-19(18)24/h7,9-10,13,16,20,24H,6,8,11-12,14H2,1-5H3/t16-,20+,22+,23+/m0/s1

InChIKey: InChIKey=TWZHUXQQMDYCHL-DQOBCGMHSA-N

Formula: C23H32O3

Molecular Weight: 356.499245

Exact Mass: 356.235145

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Salmoun, M., Devijver, C., Daloze, D., Braekman, J.C., Gomez, R., de Kluijver, M., Van Soest, R.W. J Nat Prod (2000) 63, 452-6

Species:

Notes: Family : Terpenoids, Type : Merosesquiterpenoids, Group : Friedodrimanes; 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) 20.6
2 (CH2) 26.8
3 (CH) 121.3
4 (C) 144.8
5 (C) 39
6 (CH2) 36.7
7 (CH2) 28.4
8 (CH) 36.5
9 (C) 42.4
10 (CH) 46.3
11 (CH3) 18.8
12 (CH3) 20.7
13 (CH3) 18.4
14 (CH3) 18.3
15 (CH2) 37.9
1' (C) 125.7
2' (C) 159.6
3' (CH) 116
4' (CH) 130
5' (C) 122.7
6' (CH) 135.9
3'a (C) 167.8
3'b (CH3) 52.5