20-Hydroxymulin-11, 13-dienyl acetate

20-Hydroxymulin-11, 13-dienyl acetate

Common Name: 20-Hydroxymulin-11, 13-dienyl acetate

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C22H34O2/c1-15(2)18-8-9-20-19-7-6-16(3)10-11-21(19,5)12-13-22(18,20)14-24-17(4)23/h6-7,10,15,18-20H,8-9,11-14H2,1-5H3/t18-,19+,20+,21-,22+/m1/s1

InChIKey: InChIKey=JTRPYFROXUECQY-CTWRKMMKSA-N

Formula: C22H34O2

Molecular Weight: 330.504985

Exact Mass: 330.25588

NMR Solvent: C6D6

MHz:

Calibration:

NMR references: 13C - Loyola, L.A., Borquez, J., Morales, G., San-Martin, A., Darias, J., Flores, N., Gimenez, A. Phytochemistry (2004) 65, 1931-5

Species:

Notes: Family : Terpenoids, Type : Diterpenoids, Group : Mulinanes; 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) 23.1
2 (CH2) 28
3 (CH) 57.6
4 (CH) 31.3
5 (C) 46.5
6 (CH2) 30.4
7 (CH2) 38.7
8 (C) 34.6
9 (CH) 48.8
10 (CH) 53.6
11 (CH) 132.5
12 (CH) 127.4
13 (C) 135.5
14 (CH) 125.3
15 (CH2) 36.3
16 (CH3) 25.5
17 (CH3) 26.9
18 (CH3) 22.6
19 (CH3) 23.5
20 (CH2) 61.5
20a (C) 169.7
20b (CH3) 20.1