Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C24H25N3O8/c1-30-17-5-11(6-18(31-2)22(17)32-3)19-12-7-15-16(35-10-34-15)8-13(12)21-14(20(19)23(28)33-4)9-27(26-21)24(25)29/h5-8,14,19-20H,9-10H2,1-4H3,(H2,25,29)/t14-,19+,20-/m0/s1
InChIKey: InChIKey=PYKOZLPFSYWTLO-KPOBHBOGSA-N
Formula: C24H25N3O8
Molecular Weight: 483.471649
Exact Mass: 483.164165
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Castro, M.A., Miguel del Corral, M., Lopez-Vazquez, L., Garcia, P.A., San Feliciano, A. Magn Reson Chem (1985) 23, 389
Species:
Notes: Family : Lignans, Type : Lignans, Group : Cyclolignans; 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) | 126.4 |
2 (C) | 133.2 |
3 (CH) | 108.9 |
4 (C) | 148.6 |
5 (C) | 148.6 |
6 (CH) | 106.4 |
7 (C) | 154.1 |
8 (CH) | 43.5 |
9 (CH2) | 75.8 |
1' (C) | 138.2 |
2' (CH) | 107.5 |
3' (C) | 153.4 |
4' (C) | 140.4 |
5' (C) | 153.4 |
6' (CH) | 107.5 |
7' (CH) | 43.5 |
8' (CH) | 53.1 |
9' (C) | 174.3 |
4a (CH2) | 102.5 |
9a (C) | 194.2 |
3'a (CH3) | 56.4 |
4'a (CH3) | 60.8 |
5'a (CH3) | 56.4 |
9'a (CH3) | 51.9 |