Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C25H34O10/c1-12-18(35-20(28)13(2)26)19(33-14(3)27)25-17(9-16(34-22(25)30)10-24(25)11-32-24)23(12,4)7-5-15-6-8-31-21(15)29/h12,15-19,22,30H,5-11H2,1-4H3/t12-,15+,16-,17-,18-,19+,22+,23+,24+,25+/m1/s1
InChIKey: InChIKey=YCMKSIIKTUJUCM-VOUGNFEOSA-N
Formula: C25H34O10
Molecular Weight: 494.532432
Exact Mass: 494.215197
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Rodriguez, B., DelaTorre, M.C., GomezSerranillos, P. Phytochemistry (1996) 41, 247-53
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Clerodanes; 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) | 28.1 |
2 (CH) | 66.6 |
3 (CH2) | 36.7 |
4 (C) | 60.7 |
5 (C) | 43.4 |
6 (CH) | 75.8 |
7 (CH) | 70.8 |
8 (CH) | 39 |
9 (C) | 43.4 |
10 (CH) | 40.2 |
11 (CH2) | 30.7 |
12 (CH2) | 23.2 |
13 (CH) | 39.9 |
14 (CH2) | 26.9 |
15 (CH2) | 66.3 |
16 (C) | 178.7 |
17 (CH3) | 10.6 |
18 (CH2) | 49.4 |
19 (CH) | 93.2 |
20 (CH3) | 18 |
6a (C) | 168.7 |
6b (CH3) | 20.8 |
7a (C) | 160.4 |
7b (C) | 192.5 |
7c (CH3) | 26.9 |