Spektraris NMR
Saggenon M
Common Name: Saggenon M
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C25H24O7/c1-13(2)7-10-24-22(28)20-17(27)12-18-15(8-9-23(3,4)30-18)21(20)32-25(24,29)16-6-5-14(26)11-19(16)31-24/h5-9,11-12,26-27,29H,10H2,1-4H3
InChIKey: InChIKey=MHRZMNXTSUHNDN-UHFFFAOYSA-N
Formula: C25H24O7
Molecular Weight: 436.45481
Exact Mass: 436.152203
NMR Solvent: CD3COCD3
MHz:
Calibration:
NMR references: 13C - Y. Hano, M. Itoh, N. Koyama, T. Nomura Heterocycles (1984) 22, 1971
Species:
Notes: Family : Flavonoids, Type : Flavonoids, Group : Flavanones; 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) | 102.1 |
| 3 (C) | 92.5 |
| 4 (C) | 188.8 |
| 5 (C) | 157.5 |
| 6 (CH) | 97.6 |
| 7 (C) | 165.5 |
| 8 (C) | 102.6 |
| 9 (C) | 164.4 |
| 10 (C) | 100.8 |
| 1' (C) | 121 |
| 2' (CH) | 125.6 |
| 3' (CH) | 110 |
| 4' (C) | 161.5 |
| 5' (CH) | 99.6 |
| 6' (C) | 161.2 |
| 3a (CH2) | 32.1 |
| 3b (CH) | 118.7 |
| 3c (C) | 136.9 |
| 3d (CH3) | 18.1 |
| 3e (CH3) | 25.9 |
| 8a (CH) | 115.9 |
| 8b (CH) | 127.2 |
| 8c (C) | 79.3 |
| 8d (CH3) | 28.5 |
| 8e (CH3) | 28.4 |
