Spektraris NMR
5-Deoxy-7-methylbostrycoidin
Common Name: 5-Deoxy-7-methylbostrycoidin
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C16H13NO4/c1-7-4-9-11(6-17-7)16(20)13-10(15(9)19)5-12(21-3)8(2)14(13)18/h4-6,18H,1-3H3
InChIKey: InChIKey=VGBBISRTVGXTLB-UHFFFAOYSA-N
Formula: C16H13N1O4
Molecular Weight: 283.279367
Exact Mass: 283.084458
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Moriyasu, Y., Miyagawa, H., Hamada, N., Miyawaki, H., Ueno, T. Phytochemistry (2001) 58, 239-41
Species:
Notes: Family : Aromatics, Type : Anthraquinones, Group : Aza-anthraquinones; 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 (CH) | 148.9 |
| 3 (C) | 165.7 |
| 4 (CH) | 118.5 |
| 5 (CH) | 102.7 |
| 6 (C) | 163.7 |
| 7 (C) | 122 |
| 8 (C) | 162.2 |
| 9 (C) | 186.7 |
| 10 (C) | 182.5 |
| 1''' (CH3) | 25.3 |
| 1'''''' (CH3) | 56.3 |
| 1''''''' (CH3) | 8.3 |
| 4a (C) | 138.7 |
| 8a (C) | 110.1 |
| 9a (C) | 124.2 |
| 10a (C) | 131.8 |
