Spektraris NMR
Amoenolide H
Common Name: Amoenolide H
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C25H40O9/c1-23(13-26)7-4-8-24(2)17(6-5-14-9-18(28)32-11-14)25(3,31)10-16(21(23)24)34-22-20(30)19(29)15(27)12-33-22/h9,15-17,19-22,26-27,29-31H,4-8,10-13H2,1-3H3/t15-,16-,17+,19-,20+,21-,22-,23-,24+,25+/m0/s1
InChIKey: InChIKey=YXVVESMJRSILBK-HCPHZAAZSA-N
Formula: C25H40O9
Molecular Weight: 484.580672
Exact Mass: 484.267233
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - O'Mathuna, D.P., Doskotch, R.W. J Nat Prod (1995) 58, 82-92
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Labdanes; 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) | 40.13 |
| 2 (CH2) | 18.42 |
| 3 (CH2) | 38.52 |
| 4 (C) | 38.77 |
| 5 (CH) | 53.48 |
| 6 (CH) | 79.64 |
| 7 (CH2) | 51.98 |
| 8 (C) | 72.57 |
| 9 (CH) | 61.02 |
| 10 (C) | 39.24 |
| 11 (CH2) | 23.49 |
| 12 (CH2) | 31.66 |
| 13 (C) | 172.75 |
| 14 (CH) | 114.89 |
| 15 (C) | 174.69 |
| 16 (CH2) | 73.55 |
| 17 (CH3) | 26.04 |
| 18 (CH2) | 73.48 |
| 19 (CH3) | 18.93 |
| 20 (CH3) | 17.21 |
| 1' (CH) | 105.51 |
| 2' (CH) | 72.62 |
| 3' (CH) | 74.34 |
| 4' (CH) | 68.46 |
| 5' (CH2) | 65.55 |
