Common Name:

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C25H25NO9/c1-13(27)35-26-11-16-6-14-7-18-19(34-12-33-18)10-17(14)22(23(16)25(28)32-5)15-8-20(29-2)24(31-4)21(9-15)30-3/h6-11,22-23H,12H2,1-5H3/b26-11+/t22-,23-/m1/s1

InChIKey: InChIKey=LAIGKKZGAYOYAJ-IXYPFZPMSA-N

Formula: C25H25N1O9

Molecular Weight: 483.468304

Exact Mass: 483.152931

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)

Carbon NMR Peaks

Position PPM
1 (C) 131.7
2 (C) 126.8
3 (CH) 109.8
4 (C) 148.6
5 (C) 147.1
6 (CH) 107.3
7 (CH) 133.3
8 (C) 126.4
9 (CH) 151.5
1' (C) 138.3
2' (CH) 105.1
3' (C) 153.5
4' (C) 137.7
5' (C) 153.5
6' (CH) 105.1
7' (CH) 46.6
8' (CH) 46.6
9' (C) 172.4
4a (CH2) 101.2
9a (C) 170.5
9b (CH3) 20.7
3'a (CH3) 56.7
4'a (CH3) 60.7
5'a (CH3) 56.7
9'a (CH3) 52.8