Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C26H36O9/c1-12(2)21(29)35-23-26-17(9-16(32-23)10-25(26)11-30-25)24(5,13(3)6-19(26)31-14(4)27)18-7-15-8-20(28)34-22(15)33-18/h12-13,15-19,22-23H,6-11H2,1-5H3/t13-,15+,16+,17-,18+,19+,22-,23-,24+,25+,26+/m1/s1
InChIKey: InChIKey=VMPXLSLHFGFQEU-ZZFYUPTBSA-N
Formula: C26H36O9
Molecular Weight: 492.559645
Exact Mass: 492.235933
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Bruno, M., Piozzi, F., Rodriguez, B., delaTorre, M.C., Vassallo, N., Servettaz, O. Phytochemistry (1996) 42, 1059-64
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) | 28.2 |
2 (CH) | 67 |
3 (CH2) | 36.5 |
4 (C) | 60.2 |
5 (C) | 41 |
6 (CH) | 68 |
7 (CH2) | 33.2 |
8 (CH) | 35.2 |
9 (C) | 41.2 |
10 (CH) | 40.9 |
11 (CH) | 84.9 |
12 (CH2) | 32.9 |
13 (CH) | 37.6 |
14 (CH2) | 35 |
15 (C) | 175 |
16 (CH) | 106.9 |
17 (CH3) | 16.6 |
18 (CH2) | 49.8 |
19 (CH) | 91.2 |
20 (CH3) | 13.6 |
6a (C) | 169.7 |
6b (CH3) | 21.1 |
19a (C) | 175.4 |
19b (CH) | 34.1 |
19c (CH3) | 18.8 |
19ba (CH3) | 18.1 |