4'-Hydroxy-3,7,3',5'-tetramethoxyflavone

Details

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Internal ID 3c71373f-4cd4-4c21-9b1e-679dd2bb7cbd
Taxonomy Phenylpropanoids and polyketides > Flavonoids > O-methylated flavonoids > 7-O-methylated flavonoids
IUPAC Name 2-(4-hydroxy-3,5-dimethoxyphenyl)-3,7-dimethoxychromen-4-one
SMILES (Canonical) COC1=CC2=C(C=C1)C(=O)C(=C(O2)C3=CC(=C(C(=C3)OC)O)OC)OC
SMILES (Isomeric) COC1=CC2=C(C=C1)C(=O)C(=C(O2)C3=CC(=C(C(=C3)OC)O)OC)OC
InChI InChI=1S/C19H18O7/c1-22-11-5-6-12-13(9-11)26-18(19(25-4)16(12)20)10-7-14(23-2)17(21)15(8-10)24-3/h5-9,21H,1-4H3
InChI Key JPZRECLLDITGML-UHFFFAOYSA-N
Popularity 1 reference in papers

Physical and Chemical Properties

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Molecular Formula C19H18O7
Molecular Weight 358.30 g/mol
Exact Mass 358.10525291 g/mol
Topological Polar Surface Area (TPSA) 83.40 Ų
XlogP 2.90

Synonyms

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LMPK12111582

2D Structure

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2D Structure of 4'-Hydroxy-3,7,3',5'-tetramethoxyflavone

3D Structure

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ADMET Properties (via admetSAR 2)

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Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

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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 99.24% 91.11%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 96.70% 94.00%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 95.15% 95.56%
CHEMBL1806 P11388 DNA topoisomerase II alpha 93.41% 89.00%
CHEMBL1860 P10827 Thyroid hormone receptor alpha 91.84% 99.15%
CHEMBL2581 P07339 Cathepsin D 88.72% 98.95%
CHEMBL1293249 Q13887 Kruppel-like factor 5 88.56% 86.33%
CHEMBL1907 P15144 Aminopeptidase N 87.64% 93.31%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 87.23% 94.45%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 87.10% 96.00%
CHEMBL2373 P21730 C5a anaphylatoxin chemotactic receptor 86.71% 92.62%
CHEMBL3060 Q9Y345 Glycine transporter 2 86.26% 99.17%
CHEMBL4208 P20618 Proteasome component C5 82.47% 90.00%
CHEMBL3401 O75469 Pregnane X receptor 80.95% 94.73%
CHEMBL3864 Q06124 Protein-tyrosine phosphatase 2C 80.78% 94.42%
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 80.52% 85.14%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 80.48% 99.23%
CHEMBL4306 P22460 Voltage-gated potassium channel subunit Kv1.5 80.03% 94.03%

Plants that contains it

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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.
Duroia hirsuta

Cross-Links

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PubChem 10642125
LOTUS LTS0052340
wikiData Q105133406