Common Name:

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C23H23N3O8/c1-30-16-4-10(5-17(31-2)21(16)32-3)18-11-6-14-15(34-9-33-14)7-12(11)20-13(19(18)22(27)28)8-26(25-20)23(24)29/h4-7,13,18-19H,8-9H2,1-3H3,(H2,24,29)(H,27,28)/t13-,18+,19-/m0/s1

InChIKey: InChIKey=HIUPJTZQIMJBOG-BKTGTZMESA-N

Formula: C23H23N3O8

Molecular Weight: 469.445032

Exact Mass: 469.148515

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) 126.4
2 (C) 133.3
3 (CH) 108.9
4 (C) 150.3
5 (C) 148.6
6 (CH) 106.4
7 (C) 154.4
8 (CH) 43.5
9 (CH2) 75.8
1' (C) 138.1
2' (CH) 107.2
3' (C) 153.3
4' (C) 140.3
5' (C) 153.3
6' (CH) 107.2
7' (CH) 43.5
8' (CH) 53.2
9' (C) 174.6
4a (CH2) 102.5
9a (C) 194.3
3'a (CH3) 56.3
4'a (CH3) 60.8
5'a (CH3) 56.3