Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H34O7/c1-13(23)26-11-20(3)16-8-18(25)21-9-14(22(10-21)27-12-28-29-22)4-5-15(21)19(16,2)7-6-17(20)24/h14-18,24-25H,4-12H2,1-3H3/t14-,15+,16+,17-,18+,19+,20-,21-,22?/m1/s1
InChIKey: InChIKey=BJRNRJWXJDCUEJ-RJZPEHDSSA-N
Formula: C22H34O7
Molecular Weight: 410.50201
Exact Mass: 410.230453
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) | 37.8 |
2 (CH2) | 26.1 |
3 (CH) | 71.8 |
4 (C) | 41.4 |
5 (CH) | 37.8 |
6 (CH2) | 26.7 |
7 (CH) | 76.1 |
8 (C) | 46.6 |
9 (CH) | 50 |
10 (C) | 38.5 |
11 (CH2) | 17.3 |
12 (CH2) | 25.6 |
13 (CH) | 43.3 |
14 (CH2) | 35.9 |
15 (CH2) | 46.5 |
16 (C) | 116 |
17 (CH2) | 93.2 |
18 (CH2) | 65.8 |
19 (CH3) | 11.7 |
20 (CH3) | 17.8 |
18a (C) | 171.8 |
18b (CH3) | 21 |