(1S*, 3R*, 4R*, 6S*, 11S*)-3,4-Epoxy-6-hydroxy-dolabella-7E, 12-dien-14-one

(1S*, 3R*, 4R*, 6S*, 11S*)-3,4-Epoxy-6-hydroxy-dolabella-7E, 12-dien-14-one

Common Name: (1S*, 3R*, 4R*, 6S*, 11S*)-3,4-Epoxy-6-hydroxy-dolabella-7E, 12-dien-14-one

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C20H30O3/c1-12(2)15-9-17(22)19(4)11-18-20(5,23-18)10-14(21)8-13(3)6-7-16(15)19/h8-9,12,14,16,18,21H,6-7,10-11H2,1-5H3/b13-8+/t14-,16-,18-,19+,20-/m1/s1

InChIKey: InChIKey=ZKFQUXJPKUAAGK-YNQXRIFPSA-N

Formula: C20H30O3

Molecular Weight: 318.451155

Exact Mass: 318.219495

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Hinkley, S.F., Mazzola, E.P., Fettinger, J.C., Lam, Y.F., Jarvis, B.B. Phytochemistry (2000) 55, 663-73

Species:

Notes: Family : Terpenoids, Type : Diterpenoids, Group : Dolabellanes; 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) 50.4
2 (CH2) 39.1
3 (CH) 62.7
4 (C) 60.1
5 (CH2) 47.3
6 (CH) 65.6
7 (CH) 130.5
8 (C) 137.1
9 (CH2) 37.4
10 (CH2) 27.7
11 (CH) 48.2
12 (C) 190.1
13 (CH) 123.8
14 (C) 212.8
15 (CH3) 15.7
16 (CH3) 17.4
17 (CH3) 16.2
18 (CH) 29.7
19 (CH3) 21.3
20 (CH3) 22.5