4-[(1R,4S,6S,8R,9S,13R,14S,16R)-14-Hydroxy-16-methylspiro[3,5-dioxatetracyclo[6.5.3.01,9.04,8]hexadecane-13,2'-oxiran]-6-yl]-2(5H)-furanone

4-[(1R,4S,6S,8R,9S,13R,14S,16R)-14-Hydroxy-16-methylspiro[3,5-dioxatetracyclo[6.5.3.01,9.04,8]hexadecane-13,2'-oxiran]-6-yl]-2(5H)-furanone

Common Name: 4-[(1R,4S,6S,8R,9S,13R,14S,16R)-14-Hydroxy-16-methylspiro[3,5-dioxatetracyclo[6.5.3.01,9.04,8]hexadecane-13,2'-oxiran]-6-yl]-2(5H)-furanone

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C20H26O6/c1-11-5-15(21)20-10-24-17-19(11,14(20)3-2-4-18(20)9-25-18)7-13(26-17)12-6-16(22)23-8-12/h6,11,13-15,17,21H,2-5,7-10H2,1H3/t11-,13+,14-,15+,17?,18+,19-,20+/m1/s1

InChIKey: InChIKey=OIOHVBZYRXGEPY-ASXVTQARSA-N

Formula: C20H26O6

Molecular Weight: 362.417607

Exact Mass: 362.172939

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Malakov, P.Y., Papanov, G.Y., Rodriguez, B., Delatorre, M.C., Simmonds, M.S.J., Blaney, W.M., Boneva, I.M. Phytochemistry (1994) 37, 147-57

Species:

Notes: Family : Terpenoids, Type : Diterpenoids, Group : Clerodanes; 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) 24.1
2 (CH2) 25.8
3 (CH2) 32.3
4 (C) 61.7
5 (C) 40.2
6 (CH) 73.1
7 (CH2) 37.2
8 (CH) 35.1
9 (C) 49.1
10 (CH) 46.1
11 (CH2) 37.3
12 (CH) 75.4
13 (C) 169
14 (CH) 114.9
15 (C) 173.1
16 (CH2) 70.6
17 (CH3) 16.1
18 (CH2) 51.8
19 (CH2) 61.8
20 (CH) 103.2