5-Hydroxy-7,2'-dimethoxyflavone

Details

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Internal ID afd73b6a-ef09-46e4-a21a-0ea9e49cec81
Taxonomy Phenylpropanoids and polyketides > Flavonoids > O-methylated flavonoids > 7-O-methylated flavonoids
IUPAC Name 5-hydroxy-7-methoxy-2-(2-methoxyphenyl)chromen-4-one
SMILES (Canonical) COC1=CC=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC)O
SMILES (Isomeric) COC1=CC=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC)O
InChI InChI=1S/C17H14O5/c1-20-10-7-12(18)17-13(19)9-15(22-16(17)8-10)11-5-3-4-6-14(11)21-2/h3-9,18H,1-2H3
InChI Key AYJUELGFLABMLR-UHFFFAOYSA-N
Popularity 3 references in papers

Physical and Chemical Properties

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Molecular Formula C17H14O5
Molecular Weight 298.29 g/mol
Exact Mass 298.08412354 g/mol
Topological Polar Surface Area (TPSA) 65.00 Ų
XlogP 2.40

Synonyms

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LMPK12110129

2D Structure

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2D Structure of 5-Hydroxy-7,2'-dimethoxyflavone

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 98.39% 91.11%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 97.01% 95.56%
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 96.55% 85.14%
CHEMBL2581 P07339 Cathepsin D 94.91% 98.95%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 94.13% 94.00%
CHEMBL2535 P11166 Glucose transporter 92.48% 98.75%
CHEMBL1860 P10827 Thyroid hormone receptor alpha 91.96% 99.15%
CHEMBL1806 P11388 DNA topoisomerase II alpha 90.56% 89.00%
CHEMBL1293249 Q13887 Kruppel-like factor 5 89.65% 86.33%
CHEMBL3194 P02766 Transthyretin 88.97% 90.71%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 86.15% 99.23%
CHEMBL3091268 Q92753 Nuclear receptor ROR-beta 85.11% 95.50%
CHEMBL3060 Q9Y345 Glycine transporter 2 83.21% 99.17%
CHEMBL4208 P20618 Proteasome component C5 83.16% 90.00%
CHEMBL1951 P21397 Monoamine oxidase A 81.07% 91.49%

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.
Andrographis rothii
Andrographis stenophylla
Limnophila indica

Cross-Links

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PubChem 10913533
LOTUS LTS0102803
wikiData Q104921157