Spektraris NMR
Siphonodictyal C
Common Name: Siphonodictyal C
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H30O7S/c1-13-6-7-18-21(2,3)8-5-9-22(18,4)16(13)10-14-11-17(24)19(25)15(12-23)20(14)29-30(26,27)28/h6,11-12,16,18,24-25H,5,7-10H2,1-4H3,(H,26,27,28)/t16-,18-,22+/m0/s1
InChIKey: InChIKey=IYLWUGSBDUOIDL-SGXKBVARSA-N
Formula: C22H30O7S1
Molecular Weight: 438.536332
Exact Mass: 438.171224
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Mukku, V.J., Edrada, R.A., Schmitz, F.J., Shanks, M.K., Chaudhuri, B., Fabbro, D. J Nat Prod (2003) 66, 686-9
Species:
Notes: Family : Terpenoids, Type : Merosesquiterpenoids, Group : Drimanes; 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 (CH2) | 40.9 |
| 2 (CH2) | 19.9 |
| 3 (CH2) | 43.5 |
| 4 (C) | 33.9 |
| 5 (CH) | 51.7 |
| 6 (CH2) | 24.8 |
| 7 (CH) | 122.9 |
| 8 (C) | 136.6 |
| 9 (CH) | 56.5 |
| 10 (C) | 38 |
| 11 (CH2) | 27.3 |
| 12 (CH3) | 22.7 |
| 13 (CH3) | 33.8 |
| 14 (CH3) | 22.4 |
| 15 (CH3) | 14.4 |
| 1' (C) | 130.5 |
| 2' (C) | 149.3 |
| 3' (C) | 116.6 |
| 4' (C) | 144.8 |
| 5' (C) | 143.8 |
| 6' (CH) | 123.4 |
| 3'a (CH) | 198.1 |
