Common Name:

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C43H64O5/c1-27-11-15-32-38(3,4)19-9-20-39(32,5)31(27)14-12-29-17-23-42(24-18-29)30-13-16-33-40(6)21-10-22-41(7,37(46)47-8)34(40)25-35(48-28(2)44)43(33,26-30)36(42)45/h17,30-35H,1,9-16,18-26H2,2-8H3/t30-,31?,32?,33+,34+,35+,39+,40+,41-,42?,43-/m1/s1

InChIKey: InChIKey=XFVAWGDLRDKXQW-YIXUMDELSA-N

Formula: C43H64O5

Molecular Weight: 660.966876

Exact Mass: 660.475375

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Takahashi, J.A., Boaventura, M.A.D., Bayma, J.D., Oliveira, A.B. Phytochemistry (1995) 40, 607-9

Species:

Notes: Family : Terpenoids, Type : Diterpenoids, Group : Kauranes; 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) 39.6
2 (CH2) 19.2
3 (CH2) 38.2
4 (C) 43.1
5 (CH) 47.7
6 (CH2) 26.4
7 (CH) 72.4
8 (C) 52.2
9 (CH) 48.1
10 (C) 39.5
11 (CH2) 18.6
12 (CH2) 33.9
13 (CH) 35.7
14 (CH2) 33.5
15 (C) 223.2
16 (C) 51.4
17 (CH2) 24.3
18 (CH3) 28.3
19 (C) 177.5
20 (CH3) 15
1' (CH2) 39
2' (CH2) 18.6
3' (CH2) 42.2
4' (C) 33.5
5' (CH) 55.6
6' (CH2) 24.9
7' (CH2) 37.6
8' (C) 148.3
9' (CH) 55.8
10' (C) 39.3
11' (CH2) 21.5
12' (CH2) 35.9
13' (C) 137.7
14' (CH) 117.4
15' (CH2) 26.8
16' (CH2) 25.8
17' (CH2) 106.1
18' (CH3) 33.5
19' (CH3) 21.3
20' (CH3) 14.4
7a (C) 170.5
7b (CH3) 21.3
19a (CH3) 51