Spektraris NMR
Mycaperoxide H
Common Name: Mycaperoxide H
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C24H40O4/c1-16-9-10-18-19(8-7-12-22(18,3)4)24(16,6)15-14-23(5)13-11-20(27-28-23)17(2)21(25)26/h8,16-18,20H,7,9-15H2,1-6H3,(H,25,26)/t16-,17+,18-,20+,23+,24-/m1/s1
InChIKey: InChIKey=GDGRBTCRWIRALV-LXCIQGLGSA-N
Formula: C24H40O4
Molecular Weight: 392.572911
Exact Mass: 392.29266
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Phuwapraisirisan, P., Matsunaga, S., Fusetani, N., Chaitanawisuti, N., Kritsanapuntu, S., Menasveta, P. J Nat Prod (2003) 66, 289-91
Species:
Notes: Family : Terpenoids, Type : Sesterterpenoids, Group : Bicarbocyclics; 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) | 118.3 |
| 2 (CH2) | 24.2 |
| 3 (CH2) | 32.5 |
| 4 (C) | 32.2 |
| 5 (CH) | 44.6 |
| 6 (CH2) | 31.4 |
| 7 (CH2) | 32.2 |
| 8 (CH) | 46.2 |
| 9 (C) | 43.3 |
| 10 (C) | 147.4 |
| 11 (CH2) | 24.7 |
| 12 (CH2) | 35.2 |
| 13 (C) | 81.4 |
| 14 (CH2) | 33.6 |
| 15 (CH2) | 23.8 |
| 16 (CH) | 83.3 |
| 17 (CH) | 44.1 |
| 18 (C) | 178.2 |
| 20 (CH3) | 13.4 |
| 21 (CH3) | 21 |
| 22 (CH3) | 16.7 |
| 23 (CH3) | 28.1 |
| 24 (CH3) | 28.5 |
| 25 (CH3) | 23.6 |
