(1S,3S,4S,7S,8S,11S,12R)-(+)-3,4:7,8-Diepoxiverticillan-12-ol

(1S,3S,4S,7S,8S,11S,12R)-(+)-3,4:7,8-Diepoxiverticillan-12-ol

Common Name: (1S,3S,4S,7S,8S,11S,12R)-(+)-3,4:7,8-Diepoxiverticillan-12-ol

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C20H34O3/c1-17(2)13-6-9-18(3,21)14(17)7-10-19(4)15(22-19)8-11-20(5)16(12-13)23-20/h13-16,21H,6-12H2,1-5H3/t13-,14-,15-,16-,18+,19-,20-/m0/s1

InChIKey: InChIKey=QAKDMKNAZDPAHI-HIQFCVFCSA-N

Formula: C20H34O3

Molecular Weight: 322.482918

Exact Mass: 322.250795

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Cerda-Garcia-Rojas, C.M., Garcia-Gutierrez, H.A., Hernandez-Hernandez, J.D., Roman-Marin, L.U., Joseph-Nathan, P. J Nat Prod (2007) 70, 1167-72

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 (CH) 42.7
2 (CH2) 34.6
3 (CH) 64.3
4 (C) 63
5 (CH2) 38.1
6 (CH2) 23.8
7 (CH) 66.4
8 (C) 61.5
9 (CH2) 40
10 (CH2) 20.5
11 (CH) 45.4
12 (C) 72.8
13 (CH2) 39
14 (CH2) 26.2
15 (C) 36.7
16 (CH3) 25.3
17 (CH3) 30.5
18 (CH3) 32.9
19 (CH3) 16.8
20 (CH3) 15.9