Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C29H38O5/c1-18-15-29-16-21(18)10-11-22(29)27(3)13-12-25(34-26(32)20-8-6-5-7-9-20)28(4,17-33-19(2)30)23(27)14-24(29)31/h5-9,21-25,31H,1,10-17H2,2-4H3/t21-,22+,23+,24+,25-,27+,28-,29+/m1/s1
InChIKey: InChIKey=WGOBVOHLFZLOCK-GMCWBKITSA-N
Formula: C29H38O5
Molecular Weight: 466.610114
Exact Mass: 466.271924
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Bruno, M., Rosselli, S., Pibiri, I., Piozzi, F., Bondi, M.L., Simmonds, M.S. Phytochemistry (2001) 58, 463-74
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)
Position | PPM |
---|---|
1 (CH2) | 38.3 |
2 (CH2) | 23 |
3 (CH) | 75.1 |
4 (C) | 40.7 |
5 (CH) | 38.1 |
6 (CH2) | 27 |
7 (CH) | 76.5 |
8 (C) | 47.9 |
9 (CH) | 49.9 |
10 (C) | 38.6 |
11 (CH2) | 17.8 |
12 (CH2) | 33.4 |
13 (CH) | 43.5 |
14 (CH2) | 37.7 |
15 (CH2) | 44.9 |
16 (C) | 154.7 |
17 (CH2) | 103.5 |
18 (CH2) | 65 |
19 (CH3) | 13.2 |
20 (CH3) | 17.8 |
3a (C) | 165.7 |
3b (C) | 130.5 |
3c (CH) | 129.4 |
3d (CH) | 128.2 |
3e (CH) | 132.8 |
3f (CH) | 128.2 |
3g (CH) | 129.4 |
18a (C) | 171.4 |
18b (CH3) | 21 |