4'-Hydroxy-5,6,7,8,3',5'-hexamethoxyflavone
Internal ID | f75eb423-d517-4fda-80af-1628f0c51680 |
Taxonomy | Phenylpropanoids and polyketides > Flavonoids > O-methylated flavonoids > 8-O-methylated flavonoids |
IUPAC Name | 2-(4-hydroxy-3,5-dimethoxyphenyl)-5,6,7,8-tetramethoxychromen-4-one |
SMILES (Canonical) | COC1=CC(=CC(=C1O)OC)C2=CC(=O)C3=C(O2)C(=C(C(=C3OC)OC)OC)OC |
SMILES (Isomeric) | COC1=CC(=CC(=C1O)OC)C2=CC(=O)C3=C(O2)C(=C(C(=C3OC)OC)OC)OC |
InChI | InChI=1S/C21H22O9/c1-24-13-7-10(8-14(25-2)16(13)23)12-9-11(22)15-17(26-3)19(27-4)21(29-6)20(28-5)18(15)30-12/h7-9,23H,1-6H3 |
InChI Key | FBAFEXJDBWVSTQ-UHFFFAOYSA-N |
Popularity | 1 reference in papers |
Molecular Formula | C21H22O9 |
Molecular Weight | 418.40 g/mol |
Exact Mass | 418.12638228 g/mol |
Topological Polar Surface Area (TPSA) | 102.00 Ų |
XlogP | 2.70 |
4'-Hydroxy-5,6,7,8,3',5'-hexamethoxyflavone |
85644-03-7 |
LMPK12111490 |
AKOS040734229 |
FS-8478 |
5,6,7,8,3',5'-hexamethoxy-4'-hydroxyflavone |
Target | Value | Probability (raw) | Probability (%) |
---|---|---|---|
No predicted properties yet! |
Proven Targets:
CHEMBL ID | UniProt ID | Name | Min activity | Assay type | Source |
---|---|---|---|---|---|
No proven targets yet! |
Predicted Targets (via Super-PRED):
CHEMBL ID | UniProt ID | Name | Probability | Model accuracy |
---|---|---|---|---|
CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 96.46% | 91.11% |
CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 95.51% | 94.00% |
CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 92.60% | 85.14% |
CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 90.53% | 89.00% |
CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 89.17% | 95.56% |
CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 89.07% | 86.33% |
CHEMBL1163101 | O75460 | Serine/threonine-protein kinase/endoribonuclease IRE1 | 88.92% | 98.11% |
CHEMBL2581 | P07339 | Cathepsin D | 88.29% | 98.95% |
CHEMBL3401 | O75469 | Pregnane X receptor | 83.57% | 94.73% |
CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 83.56% | 99.17% |
CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 83.04% | 99.15% |
Below are displayed all the plants proven (via scientific papers) to contain this
compound!
To see more specific details click the taxa you are interested in.
To see more specific details click the taxa you are interested in.
Ageratum conyzoides |
Eupatorium leucolepis |
PubChem | 44258653 |
LOTUS | LTS0069387 |
wikiData | Q104966522 |