Spektraris NMR
Fusaquinon B
Common Name: Fusaquinon B
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C16H20O8/c1-16(23)4-5-8(14(21)15(16)22)13(20)9-6(17)3-7(24-2)12(19)10(9)11(5)18/h3,5,8,11,14-15,17-19,21-23H,4H2,1-2H3/t5-,8-,11+,14-,15+,16-/m1/s1
InChIKey: InChIKey=BECCUNGYVJUQCO-IBUKTHIMSA-N
Formula: C16H20O8
Molecular Weight: 340.325829
Exact Mass: 340.115818
NMR Solvent: DMSO-d6
MHz:
Calibration:
NMR references: 13C - Chen, Y., Cai, X., Pan, J., Gao, J., Li, J., Yuan, J., Fu, L., She, Z., Lin, Y. Magn Reson Chem (2009) 47, 362-5
Species:
Notes: Family : Aromatics, Type : Anthraquinones, Group : 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 (C) | 137.5 |
| 2 (C) | 155.9 |
| 3 (CH) | 99.1 |
| 4 (C) | 157.1 |
| 4a (C) | 108 |
| 5 (CH) | 69.6 |
| 6 (CH) | 77.8 |
| 7 (C) | 69.9 |
| 8 (CH2) | 39.54 |
| 8a (CH) | 39.51 |
| 9 (CH) | 71.7 |
| 9a (C) | 127.6 |
| 10 (C) | 203.7 |
| 10a (CH) | 52.1 |
| 2a (CH3) | 55.9 |
| 7a (CH3) | 27 |
