Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C28H38O14/c1-36-16-5-12(6-17(37-2)21(16)31)26-14(9-29)15(11-40-28-25(35)24(34)23(33)20(10-30)41-28)27(42-26)13-7-18(38-3)22(32)19(8-13)39-4/h5-8,14-15,20,23-35H,9-11H2,1-4H3/t14-,15+,20+,23+,24-,25+,26+,27-,28+/m0/s1
InChIKey: InChIKey=FHFLZYGQOCDSKY-SDRQZZKBSA-N
Formula: C28H38O14
Molecular Weight: 598.594023
Exact Mass: 598.226156
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Kanchanapoom T., Kamel M.S., Kasai R., Yamasaki K., Picheansoonthon C., Hiraga Y. Phytochemistry (2001) 56, 369-72
Species:
Notes: Family : Lignans, Type : Lignans, Group : 7-7-Monoepoxylignans; 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) | 133.7 |
2 (CH) | 104.8 |
3 (C) | 149.2 |
4 (C) | 136.9 |
5 (C) | 149.2 |
6 (CH) | 104.8 |
7 (CH) | 83.3 |
8 (CH) | 51.8 |
9 (CH2) | 70.2 |
1' (C) | 133.9 |
2' (CH) | 104.8 |
3' (C) | 149.2 |
4' (C) | 136.9 |
5' (C) | 149.2 |
6' (CH) | 104.8 |
7' (CH) | 83.4 |
8' (CH) | 54.9 |
9' (CH2) | 61.2 |
1'' (CH) | 105 |
2'' (CH) | 75.1 |
3'' (CH) | 78.6 |
4'' (CH) | 71.4 |
5'' (CH) | 78.5 |
6'' (CH2) | 62.6 |
3a (CH3) | 56.3 |
5a (CH3) | 56.3 |
3'a (CH3) | 56.3 |
5'a (CH3) | 56.3 |