Spektraris NMR
Bipinnatolide H
Common Name: Bipinnatolide H
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H26O7/c1-9(2)13-8-15-19-17(27-19)14(25-18(19)23)6-10(3)5-12(21)7-11(4)20(24,26-15)16(13)22/h5,11,13-17,22,24H,1,6-8H2,2-4H3/b10-5-/t11-,13-,14-,15+,16-,17-,19-,20+/m0/s1
InChIKey: InChIKey=SRJWOBPDIGLBCT-YLVNIJGFSA-N
Formula: C20H26O7
Molecular Weight: 378.417012
Exact Mass: 378.167853
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Rodriguez, A.D., Shi, J.G., Huang, S.D. J Nat Prod (1999) 62, 1228-37
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Cembranes; 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) | 47 |
| 2 (CH) | 70.9 |
| 3 (C) | 97.5 |
| 4 (CH) | 43.2 |
| 5 (CH2) | 46.9 |
| 6 (C) | 200.9 |
| 7 (CH) | 129.7 |
| 8 (C) | 149 |
| 9 (CH2) | 33 |
| 10 (CH) | 78.3 |
| 11 (CH) | 60.4 |
| 12 (C) | 60.1 |
| 13 (CH) | 63 |
| 14 (CH2) | 29.5 |
| 15 (C) | 143.6 |
| 16 (CH2) | 115.2 |
| 17 (CH3) | 18.5 |
| 18 (CH3) | 16.1 |
| 19 (CH3) | 29.4 |
| 20 (C) | 170.8 |
