Spektraris NMR
Vogelin D
Common Name: Vogelin D
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C26H30O5/c1-15(2)6-8-18-12-17(9-11-22(18)30-5)20-14-31-23-13-21(27)19(10-7-16(3)4)25(28)24(23)26(20)29/h6-7,9,11-13,20,27-28H,8,10,14H2,1-5H3/t20-/m0/s1
InChIKey: InChIKey=NYKUNEKGAYOKPN-FQEVSTJZSA-N
Formula: C26H30O5
Molecular Weight: 422.514381
Exact Mass: 422.209324
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Queiroz, E.F., Atindehou, K.K., Terreaux, C., Antus, S., Hostettmann, K. J Nat Prod (2002) 65, 403-6
Species:
Notes: Family : Flavonoids, Type : Isoflavonoids, Group : Isoflavanones; 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 (CH2) | 71.3 |
| 3 (CH) | 50.6 |
| 4 (C) | 196 |
| 5 (C) | 161.3 |
| 6 (C) | 106.1 |
| 7 (C) | 163.4 |
| 8 (CH) | 95.1 |
| 9 (C) | 157.9 |
| 10 (C) | 102.4 |
| 1' (C) | 126.5 |
| 2' (CH) | 126.8 |
| 3' (C) | 130.6 |
| 4' (C) | 156.9 |
| 5' (CH) | 110.1 |
| 6' (CH) | 129.5 |
| 1'' (CH2) | 21.1 |
| 2'' (CH) | 121.3 |
| 3'' (C) | 132.8 |
| 4'' (CH3) | 17.7 |
| 5'' (CH3) | 25.7 |
| 1''' (CH2) | 28.4 |
| 2''' (CH) | 122 |
| 3''' (C) | 135.7 |
| 4''' (CH3) | 17.8 |
| 5''' (CH3) | 25.7 |
| 4'a (CH3) | 55.4 |
