Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C21H26O7/c1-12(2)20(24)27-17-8-15(10-22)6-5-7-16(11-26-14(4)23)9-18-19(17)13(3)21(25)28-18/h6,9-10,12,17-19H,3,5,7-8,11H2,1-2,4H3/b15-6+,16-9+/t17-,18-,19-/m1/s1
InChIKey: InChIKey=DGDXEWDWVPRYPG-VFVGLHNTSA-N
Formula: C21H26O7
Molecular Weight: 390.427748
Exact Mass: 390.167853
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Cartagena, E., Bardon, A., Catalan, C.A., de Hernandez, Z.N., Hernandez, L.R., Joseph-Nathan, P. J Nat Prod (2000) 63, 1323-8
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Germacranes; 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 (CH) | 153.2 |
| 2 (CH2) | 25 |
| 3 (CH2) | 26.1 |
| 4 (C) | 135 |
| 5 (CH) | 129.2 |
| 6 (CH) | 73.2 |
| 7 (CH) | 46.8 |
| 8 (CH) | 71.9 |
| 9 (CH2) | 28.6 |
| 10 (C) | 142 |
| 11 (C) | 134.4 |
| 12 (C) | 169.3 |
| 13 (CH2) | 124.7 |
| 14 (CH) | 194.8 |
| 15 (CH2) | 66.6 |
| 8a (C) | 175.7 |
| 8b (CH) | 34 |
| 8c (CH3) | 19.1 |
| 8ba (CH3) | 18.6 |
| 15a (C) | 170.4 |
| 15b (CH3) | 20.9 |