Common Name: 14,15-Dinor-labd-8-en-6α,7α,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+/m0/s1
InChIKey: InChIKey=MZTYMWXZGZVZAL-YPUSXWEJSA-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)
Position | PPM |
---|---|
1 (CH2) | 39.3 |
2 (CH2) | 18.9 |
3 (CH2) | 43.8 |
4 (C) | 33.5 |
5 (CH) | 54 |
6 (CH) | 74.7 |
7 (CH) | 80.2 |
8 (C) | 126.6 |
9 (C) | 144.1 |
10 (C) | 42.3 |
11 (CH2) | 24.6 |
12 (CH2) | 37.5 |
13 (CH) | 68.8 |
16 (CH3) | 23.4 |
17 (CH3) | 14.4 |
18 (CH3) | 36.6 |
19 (CH3) | 22.4 |
20 (CH3) | 21.6 |