9-Hydroxymegastigm-5-en-4-one

9-Hydroxymegastigm-5-en-4-one

Common Name: 9-Hydroxymegastigm-5-en-4-one

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C13H22O2/c1-9(14)5-6-11-10(2)12(15)7-8-13(11,3)4/h9,14H,5-8H2,1-4H3/t9-/m0/s1

InChIKey: InChIKey=KNHUHSLRIKTCIY-VIFPVBQESA-N

Formula: C13H22O2

Molecular Weight: 210.313073

Exact Mass: 210.16198

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Lin, T.C., Fang, J.M., Cheng, Y.S. Phytochemistry (1999) 51, 793-801

Species:

Notes: Family : Terpenoids, Type : Miscellanea, Group : Megastigmanes; 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) 36.4
2 (CH2) 26.8
3 (CH2) 34.2
4 (C) 199.1
5 (C) 130.9
6 (C) 164.7
7 (CH2) 37.4
8 (CH2) 37.9
9 (CH) 68.4
10 (CH3) 23.5
11 (CH3) 26.9
12 (CH3) 27
13 (CH3) 11.5