3,5,6-Trimethoxyfurano[2,3:7,8]flavone

Details

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Internal ID c4404932-f67e-4d73-bd88-19d430871192
Taxonomy Phenylpropanoids and polyketides > Flavonoids > Flavones > Furanoflavones
IUPAC Name 3,5,6-trimethoxy-2-phenylfuro[2,3-h]chromen-4-one
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C20H16O6/c1-22-18-13-14(21)19(23-2)15(11-7-5-4-6-8-11)26-16(13)12-9-10-25-17(12)20(18)24-3/h4-10H,1-3H3
InChI Key DESYRLMOSLWIGY-UHFFFAOYSA-N
Popularity 4 references in papers

Physical and Chemical Properties

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Molecular Formula C20H16O6
Molecular Weight 352.30 g/mol
Exact Mass 352.09468823 g/mol
Topological Polar Surface Area (TPSA) 67.10 Ų
XlogP 3.70

Synonyms

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DESYRLMOSLWIGY-UHFFFAOYSA-N
LMPK12112800
3,5,6-Trimethoxyfurano-(7,8,2'',3'')-flavone
3,5,6-Trimethoxy-2-phenyl-4H-furo[2,3-H]chromen-4-one #

2D Structure

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2D Structure of 3,5,6-Trimethoxyfurano[2,3:7,8]flavone

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 97.20% 91.11%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 95.84% 95.56%
CHEMBL2581 P07339 Cathepsin D 94.34% 98.95%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 91.45% 94.00%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 89.49% 99.23%
CHEMBL4306 P22460 Voltage-gated potassium channel subunit Kv1.5 88.24% 94.03%
CHEMBL1293249 Q13887 Kruppel-like factor 5 87.21% 86.33%
CHEMBL1806 P11388 DNA topoisomerase II alpha 85.16% 89.00%
CHEMBL3091268 Q92753 Nuclear receptor ROR-beta 83.62% 95.50%
CHEMBL3192 Q9BY41 Histone deacetylase 8 83.13% 93.99%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 82.55% 96.00%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
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There are no matching plants.

Cross-Links

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PubChem 631791
LOTUS LTS0240200
wikiData Q104977510