Spektraris NMR
Indicumolide A
Common Name: Indicumolide A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H28O6/c1-6-9(2)18(22)25-13-7-10(3)12-8-14(21)20(5,24)16(12)17-15(13)11(4)19(23)26-17/h6,11,13-17,21,24H,7-8H2,1-5H3/b9-6-/t11-,13+,14+,15-,16+,17+,20+/m1/s1
InChIKey: InChIKey=JUDSHVJBQAIZGM-STFPARNPSA-N
Formula: C20H28O6
Molecular Weight: 364.433489
Exact Mass: 364.188589
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Feng, Z.M., Song, S., Xia, P.F., Jiang, J.S., Zhang, P.C. Helv Chim Acta (2009) 92, 1823-8
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) | 137.1 |
| 2 (CH2) | 38.9 |
| 3 (CH) | 78.9 |
| 4 (C) | 83.2 |
| 5 (CH) | 52.8 |
| 6 (CH) | 79.2 |
| 7 (CH) | 58.4 |
| 8 (CH) | 71 |
| 9 (CH2) | 42.7 |
| 10 (C) | 126.5 |
| 11 (CH) | 40.7 |
| 12 (C) | 177.6 |
| 13 (CH3) | 15 |
| 14 (CH3) | 23.5 |
| 15 (CH3) | 23.9 |
| 8a (C) | 166.7 |
| 8b (C) | 127.2 |
| 8c (CH) | 139.7 |
| 8d (CH3) | 15.8 |
| 8e (CH3) | 20.5 |
