Acetate of 14,15-dinor-labd-8-en-13-R/S-ilo

Acetate of 14,15-dinor-labd-8-en-13-R/S-ilo

Common Name: Acetate of 14,15-dinor-labd-8-en-13-R/S-ilo

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C20H34O2/c1-14-8-11-18-19(4,5)12-7-13-20(18,6)17(14)10-9-15(2)22-16(3)21/h15,18H,7-13H2,1-6H3/t15?,18-,20+/m0/s1

InChIKey: InChIKey=LIUVQDFVHZPTPJ-RUTXASTPSA-N

Formula: C20H34O2

Molecular Weight: 306.483513

Exact Mass: 306.25588

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Marcos, I.S., Castaneda, L., Basabe, P., Diez, D., Urones, J.G. Tetrahedron (2008) 64, 8815-29

Species:

Notes: Family : Terpenoids, Type : Diterpenoids, Group : Labdanes; 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) 37.2
2 (CH2) 19.3
3 (CH2) 42
4 (C) 33.5
5 (CH) 52.1
6 (CH2) 19.3
7 (CH2) 33.8
8 (C) 126.2
9 (C) 140.1
10 (C) 39.2
11 (CH2) 23.7
12 (CH2) 36.8
13 (CH) 71.7
16 (CH3) 19.9
17 (CH3) 20.3
18 (CH3) 33.5
19 (CH3) 21.9
20 (CH3) 19.6
13a (C) 170.9
13b (CH3) 21.6