Epoxyeleoanolacton

Epoxyeleoanolacton

Common Name: Epoxyeleoanolacton

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C20H30O4/c1-13(2)11-16(21)12-15(4)9-5-7-14(3)8-6-10-17-18-20(23-18)24-19(17)22/h8-9,11,16-18,20-21H,5-7,10,12H2,1-4H3/b14-8+,15-9+/t16-,17?,18?,20?/m1/s1

InChIKey: InChIKey=MWCBIZFZQBYZJE-SPOQGDDGSA-N

Formula: C20H30O4

Molecular Weight: 334.45056

Exact Mass: 334.214409

NMR Solvent: C6D6

MHz:

Calibration:

NMR references: 13C - Valls, R., Piovetti, L., Banaigs, B., Archavlis, A., Pellegrini, M. Phytochemistry (1995) 39, 145-9

Species:

Notes: Family : Terpenoids, Type : Diterpenoids, Group : Phytanes; 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 (CH) 78.2
2 (CH) 54.3
3 (CH) 43.8
4 (CH2) 27.9
5 (CH2) 26.7
6 (CH) 124.5
7 (C) 134.5
8 (CH2) 40.6
9 (CH2) 27.5
10 (CH) 129.1
11 (C) 133.3
12 (CH2) 49.5
13 (CH) 67.2
14 (CH) 129.9
15 (C) 137.4
16 (CH3) 26.6
17 (CH3) 19
18 (CH3) 17.2
19 (CH3) 16.7
20 (C) 175.3