Spektraris NMR
Amphiacrolide H Diacetate
Common Name: Amphiacrolide H Diacetate
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C24H34O6/c1-16-8-11-24(15-30-18(3)26)20(14-28-17(2)25)6-5-7-21(24)23(16,4)10-9-19-12-22(27)29-13-19/h6,12,16,21H,5,7-11,13-15H2,1-4H3/t16-,21-,23+,24+/m0/s1
InChIKey: InChIKey=QFOVBSYLEHDSPP-LIUBOXQOSA-N
Formula: C24H34O6
Molecular Weight: 418.524077
Exact Mass: 418.235539
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Harraz, F.M., Pcolinski, M.J., Doskotch, R.W. J Nat Prod (1996) 59, 5-14
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Clerodanes; 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) | 17.19 |
| 2 (CH2) | 23.93 |
| 3 (CH) | 132.99 |
| 4 (C) | 134.14 |
| 5 (C) | 40.14 |
| 6 (CH2) | 30.81 |
| 7 (CH2) | 27.99 |
| 8 (CH) | 37.2 |
| 9 (C) | 40.14 |
| 10 (CH) | 38.98 |
| 11 (CH2) | 35.36 |
| 12 (CH2) | 22.14 |
| 13 (C) | 170.89 |
| 14 (CH) | 115.42 |
| 15 (C) | 174.04 |
| 16 (CH2) | 73.16 |
| 17 (CH3) | 15.96 |
| 18 (CH2) | 72.17 |
| 19 (CH2) | 66.39 |
| 20 (CH3) | 17.54 |
| 18a (C) | 170.79 |
| 18b (CH3) | 21.24 |
| 19a (C) | 170.97 |
| 19b (CH3) | 21.19 |
