Common Name: Sophoradione
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C25H28O7/c1-13(2)6-7-15(14(3)4)10-18-20(28)12-21(32-5)22(23(18)29)25(31)24(30)17-9-8-16(26)11-19(17)27/h6,8-9,11-12,15,26-29H,3,7,10H2,1-2,4-5H3
InChIKey: InChIKey=NYHVTLRKAYFBIT-UHFFFAOYSA-N
Formula: C25H28O7
Molecular Weight: 440.486573
Exact Mass: 440.183503
NMR Solvent: CD3COCD3
MHz:
Calibration:
NMR references: 13C - Shen, C.C., Lin, T.W., Huang, Y.L., Wan, S.T., Shien, B.J., Chen, C.C. J Nat Prod (2006) 69, 1237-40
Species:
Notes: Family : Aromatics, Type : Stilbenes, Group : Stilbenes; 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)
Position | PPM |
---|---|
1 (C) | 103.2 |
2 (C) | 166.4 |
3 (C) | 108.9 |
4 (C) | 167 |
5 (CH) | 92 |
6 (C) | 162.1 |
α (C) | 195.4 |
β (C) | 194.5 |
1' (C) | 110.8 |
2' (C) | 166.2 |
3' (CH) | 103.8 |
4' (C) | 166.1 |
5' (CH) | 109.5 |
6' (CH) | 134.4 |
1'' (CH2) | 27.3 |
2'' (CH) | 47.5 |
3'' (CH2) | 32.1 |
4'' (CH) | 124.4 |
5'' (C) | 131.6 |
6'' (CH3) | 17.9 |
7'' (CH3) | 25.9 |
8'' (C) | 149 |
9'' (CH2) | 111.4 |
10'' (CH3) | 18.8 |
6a (CH3) | 56.1 |