Spektraris NMR
Diversolide C
Common Name: Diversolide C
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C27H28O7/c1-14(2)11-20(29)34-27(5)23-19(32-25(30)17-9-7-6-8-10-17)13-16(4)21-18(28)12-15(3)22(21)24(23)33-26(27)31/h6-12,19,22-24H,13H2,1-5H3/t19-,22+,23+,24-,27-/m0/s1
InChIKey: InChIKey=ATFDRUGGJJIGEW-HETHRKJOSA-N
Formula: C27H28O7
Molecular Weight: 464.508045
Exact Mass: 464.183503
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Iranshahi, M., Hosseini, S.T., Shahverdi, A.R., Molazade, K., Khan, S.S., Ahmad, V.U. Phytochemistry (2008) 69, 2753-7
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Guaianes; 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)
Carbon NMR Peaks
| Position | PPM |
|---|---|
| 1 (C) | 129.1 |
| 2 (C) | 195 |
| 3 (CH) | 136.1 |
| 4 (C) | 169.2 |
| 5 (CH) | 48.1 |
| 6 (CH) | 78.4 |
| 7 (CH) | 47.2 |
| 8 (CH) | 68.3 |
| 9 (CH2) | 43.9 |
| 10 (C) | 144.9 |
| 11 (C) | 77.8 |
| 12 (C) | 173.1 |
| 13 (CH3) | 20.7 |
| 14 (CH3) | 20 |
| 15 (CH3) | 20.2 |
| 8a (C) | 165.3 |
| 8b (C) | 129.7 |
| 8c (CH) | 129.8 |
| 8d (CH) | 128.5 |
| 8e (CH) | 133.6 |
| 8f (CH) | 128.5 |
| 8g (CH) | 129.8 |
| 11a (C) | 165.1 |
| 11b (CH) | 114.4 |
| 11c (C) | 161.2 |
| 11d (CH3) | 20.5 |
| 11ca (CH3) | 27.7 |
