Spektraris NMR
Kallolide H
Common Name: Kallolide H
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H26O6/c1-11(2)16-8-7-15-10-18(28-22(15)26)19(12(3)4)17(24)9-13(5)20(25)21(16)27-14(6)23/h9-10,16,18-19,21H,1,3,7-8H2,2,4-6H3/b13-9-/t16-,18+,19-,21-/m0/s1
InChIKey: InChIKey=INCMLVABIJDPHM-CLBOVIMVSA-N
Formula: C22H26O6
Molecular Weight: 386.439079
Exact Mass: 386.172939
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Marrero, J., Ospina, C.A., Rodriguez, A.D., Baran, P., Zhao, H., Franzblau, S.G., Ortega-Barria, E. Tetrahedron (2006) 62, 6998-7008
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Pseudopteranes; 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 (CH) | 45.3 |
| 2 (CH) | 77.6 |
| 3 (C) | 202 |
| 4 (C) | 154 |
| 5 (CH) | 125.6 |
| 6 (C) | 197.6 |
| 7 (CH) | 62.1 |
| 8 (CH) | 79.5 |
| 9 (CH) | 151.6 |
| 10 (C) | 132.7 |
| 11 (CH2) | 22.1 |
| 12 (CH2) | 25.6 |
| 13 (C) | 143.7 |
| 14 (CH2) | 115 |
| 15 (CH3) | 22.1 |
| 16 (CH3) | 21.6 |
| 17 (C) | 138 |
| 18 (CH2) | 116.1 |
| 19 (CH3) | 23.1 |
| 20 (C) | 173.6 |
| 2a (C) | 170 |
| 2b (CH3) | 20.8 |
