3,5,7-Trihydroxy-6,8-dimethoxyflavone

Details

• Internal ID: 7e284856-f35e-459f-b42e-dba3273cb228
• Taxonomy: Phenylpropanoids and polyketides > Flavonoids > Flavones > Flavonols
• IUPAC Name: 3,5,7-trihydroxy-6,8-dimethoxy-2-phenylchromen-4-one
• InChI: InChI=1S/C17H14O7/c1-22-16-11(19)9-10(18)12(20)14(8-6-4-3-5-7-8)24-15(9)17(23-2)13(16)21/h3-7,19-21H,1-2H3
• InChI Key: OAFYQEVUFFOPBR-UHFFFAOYSA-N
• Popularity: 5 references in papers

Physical and Chemical Properties

• Molecular Formula: C₁₇H₁₄O₇
• Molecular Weight: 330.29 g/mol
• Exact Mass: 330.07395278 g/mol
• Topological Polar Surface Area (TPSA): 105.00 Ų
• XlogP: 2.80

Synonyms

• 33183-51-6
• SCHEMBL4627830
• DTXSID20571040
• LMPK12113292
• 3,5,7-trihydroxy-6,8-dimethoxy-2-phenyl-4H-chromen-4-one
• 3,5,7-Trihydroxy-6,8-dimethoxy-2-phenyl-4H-1-benzopyran-4-one

2D Structure

ADMET Properties (via admetSAR 2)

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

Targets

Proven Targets:

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	98.87%	91.11%
CHEMBL3108638	O15164	Transcription intermediary factor 1-alpha	94.68%	95.56%
CHEMBL2581	P07339	Cathepsin D	93.21%	98.95%
CHEMBL3038477	P67870	Casein kinase II alpha/beta	91.35%	99.23%
CHEMBL1293249	Q13887	Kruppel-like factor 5	90.32%	86.33%
CHEMBL2635	P51452	Dual specificity protein phosphatase 3	90.26%	94.00%
CHEMBL1806	P11388	DNA topoisomerase II alpha	86.96%	89.00%
CHEMBL1821	P08173	Muscarinic acetylcholine receptor M4	84.36%	94.08%
CHEMBL3091268	Q92753	Nuclear receptor ROR-beta	84.24%	95.50%
CHEMBL2002	P12268	Inosine-5'-monophosphate dehydrogenase 2	80.83%	98.21%
CHEMBL216	P11229	Muscarinic acetylcholine receptor M1	80.77%	94.23%

Plants that contains it

There are no matching plants.

Cross-Links

• PubChem: 15290459
• LOTUS: LTS0080647
• wikiData: Q82458619