Dendrillol-3

Dendrillol-3

Common Name: Dendrillol-3

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C21H32O4/c1-19(2)9-5-10-20(3)14(19)8-11-21-12-25-18(23)16(21)13(17(22)24-4)6-7-15(20)21/h13-16H,5-12H2,1-4H3/t13-,14+,15-,16+,20+,21+/m1/s1

InChIKey: InChIKey=NDSKJQVANFOGQV-QYIRSJDHSA-N

Formula: C21H32O4

Molecular Weight: 348.477178

Exact Mass: 348.23006

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Yong, K.W.L., Salim, A.A., Garson, M.J. Tetrahedron (2008) 64, 6733-8

Species:

Notes: Family : Terpenoids, Type : Diterpenoids, Group : Isocopalanes; 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) 38.2
2 (CH2) 18
3 (CH2) 41.6
4 (C) 33
5 (CH) 56.1
6 (CH2) 18.6
7 (CH2) 40.8
8 (C) 42.4
9 (CH) 49.6
10 (C) 37.6
11 (CH2) 16.9
12 (CH2) 21.8
13 (CH) 38.8
14 (CH) 50.8
15 (C) 177.2
16 (C) 173.2
17 (CH2) 72.8
18 (CH3) 33.2
19 (CH3) 21.3
20 (CH3) 14.3
16a (CH3) 51.7