Common Name: 1,3,8-trihydroxy-2-methoxyanthraquinone
Synonyms: 1,3,8-trihydroxy-2-methoxyanthraquinone
CAS Registry Number:
InChI: InChI=1S/C15H10O6/c1-21-15-9(17)5-7-11(14(15)20)13(19)10-6(12(7)18)3-2-4-8(10)16/h2-5,16-17,20H,1H3
InChIKey: InChIKey=ITLMMMUIWDPRJK-UHFFFAOYSA-N
Formula: C15H10O6
Molecular Weight: 286.236876
Exact Mass: 286.047738
NMR Solvent: DMSO-d6
MHz:
Calibration:
NMR references: 13C - Wu, Y.B., Zheng, C.J., Qin, L.P., Sun, L.N., Han, T., Jiao, L., Zhang, Q.Y., Wu, J.Z. Molecules (2009) 14, 573-83
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)
| Position | PPM |
|---|---|
| 1 (C) | 156.81 |
| 2 (C) | 139.78 |
| 3 (C) | 157.72 |
| 4 (CH) | 109.34 |
| 4a (C) | 133.2 |
| 5 (CH) | 119.11 |
| 6 (CH) | 136.96 |
| 7 (CH) | 124.37 |
| 8 (C) | 161.21 |
| 8a (C) | 115.82 |
| 9 (C) | 190.7 |
| 9a (C) | 110.11 |
| 10 (C) | 180.84 |
| 10a (C) | 129.11 |
| 2a (CH3) | 60.16 |