(1S,3R,4R)-ent-3,4-Epoxyverticilla-7,12(18)-dien-1-ol

(1S,3R,4R)-ent-3,4-Epoxyverticilla-7,12(18)-dien-1-ol

Common Name: (1S,3R,4R)-ent-3,4-Epoxyverticilla-7,12(18)-dien-1-ol

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C20H32O2/c1-14-7-6-11-19(5)17(22-19)13-20(21)12-10-15(2)16(9-8-14)18(20,3)4/h7,16-17,21H,2,6,8-13H2,1,3-5H3/b14-7+/t16-,17-,19+,20-/m0/s1

InChIKey: InChIKey=MKCVUUPPUVFWNZ-YDKLZOBOSA-N

Formula: C20H32O2

Molecular Weight: 304.467632

Exact Mass: 304.24023

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Nagashima, F., Wakayama, K., Ioka, Y., Asakawa, Y. Chem Pharm Bull (2008) 56, 1184-8

Species:

Notes: Family : Terpenoids, Type : Diterpenoids, Group : Verticillanes; 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) 76.8
2 (CH2) 42.2
3 (CH) 62.8
4 (C) 63.7
5 (CH2) 39.5
6 (CH2) 24.4
7 (CH) 127.3
8 (C) 134.4
9 (CH2) 37
10 (CH2) 20.8
11 (CH) 43.6
12 (C) 145.9
13 (CH2) 34.7
14 (CH2) 38.1
15 (C) 41.9
16 (CH3) 18.8
17 (CH3) 22.5
18 (CH2) 108.1
19 (CH3) 16.2
20 (CH3) 15.8