14,15-Dinor-labd-8-en-6β,7β,13-R/S-triol

14,15-Dinor-labd-8-en-6β,7β,13-R/S-triol

Common Name: 14,15-Dinor-labd-8-en-6β,7β,13-R/S-triol

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C18H32O3/c1-11(19)7-8-13-12(2)14(20)15(21)16-17(3,4)9-6-10-18(13,16)5/h11,14-16,19-21H,6-10H2,1-5H3/t11?,14-,15-,16+,18-/m1/s1

InChIKey: InChIKey=MZTYMWXZGZVZAL-JOYUWQJXSA-N

Formula: C18H32O3

Molecular Weight: 296.445565

Exact Mass: 296.235145

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) 36.9
2 (CH2) 16.1
3 (CH2) 40
4 (C) 30.7
5 (CH) 49.8
6 (CH) 63.8
7 (CH) 69.4
8 (C) 123.1
9 (C) 139.3
10 (C) 30.8
11 (CH2) 21.2
12 (CH2) 36.8
13 (CH) 63.8
16 (CH3) 20.8
17 (CH3) 12.1
18 (CH3) 30.8
19 (CH3) 21
20 (CH3) 18.4