Spektraris NMR
Morusin hydroperoxide
Common Name: Morusin hydroperoxide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C25H24O8/c1-24(2)8-7-14-18(32-24)11-16(27)20-21(28)15-10-19(25(3,4)33-29)30-17-9-12(26)5-6-13(17)22(15)31-23(14)20/h5-9,11,19,26-27,29H,10H2,1-4H3
InChIKey: InChIKey=FTIZDJNLUATQGK-UHFFFAOYSA-N
Formula: C25H24O8
Molecular Weight: 452.454215
Exact Mass: 452.147118
NMR Solvent: DMSO-d6
MHz:
Calibration:
NMR references: 13C - Nomura, T., Fukai, T. Heterocycles (1979) 12, 1289-95
Species:
Notes: Family : Flavonoids, Type : Flavonoids, Group : Flavones; 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 |
|---|---|
| 2 (C) | 159.8 |
| 3 (C) | 117.1 |
| 4 (C) | 181.7 |
| 5 (C) | 152.1 |
| 6 (CH) | 99.9 |
| 7 (C) | 163.6 |
| 8 (C) | 104.4 |
| 9 (C) | 161.6 |
| 10 (C) | 101.3 |
| 1' (C) | 114 |
| 2' (CH) | 158.2 |
| 3' (CH) | 112.4 |
| 4' (C) | 162.4 |
| 5' (CH) | 108.8 |
| 6' (C) | 138.8 |
| 3a (CH2) | 22.7 |
| 3b (CH) | 86 |
| 3c (C) | 82.9 |
| 3d (CH3) | 25.9 |
| 3ca (CH3) | 20.3 |
| 8a (CH) | 115.4 |
| 8b (CH) | 127.6 |
| 8c (C) | 78.3 |
| 8d (CH3) | 28.1 |
| 8ac (CH3) | 28.1 |
