Spektraris NMR
Genistein
Common Name: Genistein
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)11-7-20-13-6-10(17)5-12(18)14(13)15(11)19/h1-7,16-18H
InChIKey: InChIKey=TZBJGXHYKVUXJN-UHFFFAOYSA-N
Formula: C15H10O5
Molecular Weight: 270.237471
Exact Mass: 270.052823
NMR Solvent: CD3COCD3
MHz:
Calibration:
NMR references: 13C - Lane, G.A., Newman, R.H. Phytochemistry (1987) 26, 295-300
Species:
Notes: Family : Flavonoids, Type : Isoflavonoids, Group : Isoflavones; 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 (CH) | 154 |
| 3 (C) | 123.9 |
| 4 (C) | 181.4 |
| 5 (C) | 163.7 |
| 6 (CH) | 99.7 |
| 7 (C) | 164.7 |
| 8 (CH) | 94.3 |
| 9 (C) | 158.8 |
| 10 (C) | 106.1 |
| 1' (C) | 122.9 |
| 2' (CH) | 131 |
| 3' (CH) | 115.8 |
| 4' (C) | 158.2 |
| 5' (CH) | 115.8 |
| 6' (CH) | 131 |
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The Spektraris NMR database is developed and hosted by the Lange laboratory at WSU. CAS Registry Number is a Registered Trademark of the American Chemical Society.