Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C26H38O7/c1-15(27)30-13-24(5)20-10-22(33-17(3)29)25-11-18(26(12-25)14-31-26)6-7-19(25)23(20,4)9-8-21(24)32-16(2)28/h18-22H,6-14H2,1-5H3/t18-,19+,20+,21-,22+,23+,24-,25-,26+/m1/s1
InChIKey: InChIKey=NXQQHBXPTQOLRB-WSHIDIMTSA-N
Formula: C26H38O7
Molecular Weight: 462.576716
Exact Mass: 462.261754
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) | 37.5 |
2 (CH2) | 22.7 |
3 (CH) | 73.5 |
4 (C) | 40.1 |
5 (CH) | 39.4 |
6 (CH2) | 23.9 |
7 (CH) | 78.9 |
8 (C) | 47.5 |
9 (CH) | 49.9 |
10 (C) | 38.4 |
11 (CH2) | 18.6 |
12 (CH2) | 28.9 |
13 (CH) | 42.1 |
14 (CH2) | 36.8 |
15 (CH2) | 44.7 |
16 (C) | 65.5 |
17 (CH2) | 50.5 |
18 (CH2) | 64.6 |
19 (CH3) | 12.7 |
20 (CH3) | 18 |
3a (C) | 170.4 |
3b (CH3) | 20.9 |
7a (C) | 170.3 |
7b (CH3) | 20.9 |
18a (C) | 169.8 |
18b (CH3) | 20.7 |