7-(1,3-Benzodioxol-5-yl)-4-methoxyfuro[3,2-g]chromen-5-one

Details

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Internal ID 72803159-7297-4d7f-b1f3-b6bac2c90980
Taxonomy Phenylpropanoids and polyketides > Flavonoids > Flavones > Furanoflavones
IUPAC Name 7-(1,3-benzodioxol-5-yl)-4-methoxyfuro[3,2-g]chromen-5-one
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C19H12O6/c1-21-19-11-4-5-22-15(11)8-17-18(19)12(20)7-14(25-17)10-2-3-13-16(6-10)24-9-23-13/h2-8H,9H2,1H3
InChI Key BKQQOWSJCUCPPA-UHFFFAOYSA-N
Popularity 4 references in papers

Physical and Chemical Properties

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Molecular Formula C19H12O6
Molecular Weight 336.30 g/mol
Exact Mass 336.06338810 g/mol
Topological Polar Surface Area (TPSA) 67.10 Ų
XlogP 3.40

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 7-(1,3-Benzodioxol-5-yl)-4-methoxyfuro[3,2-g]chromen-5-one

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
CHEMBL4303 P08238 Heat shock protein HSP 90-beta 99.38% 96.77%
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 99.04% 85.14%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 97.97% 91.11%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 96.13% 94.45%
CHEMBL4225 P49760 Dual specificity protein kinase CLK2 95.64% 80.96%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 94.84% 94.00%
CHEMBL2581 P07339 Cathepsin D 94.65% 98.95%
CHEMBL4224 P49759 Dual specificty protein kinase CLK1 93.43% 85.30%
CHEMBL4306 P22460 Voltage-gated potassium channel subunit Kv1.5 92.90% 94.03%
CHEMBL1806 P11388 DNA topoisomerase II alpha 91.59% 89.00%
CHEMBL4481 P35228 Nitric oxide synthase, inducible 90.54% 94.80%
CHEMBL1293249 Q13887 Kruppel-like factor 5 88.39% 86.33%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 87.63% 95.56%
CHEMBL2717 Q9HCR9 Phosphodiesterase 11A 86.64% 85.00%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 86.59% 99.23%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 84.85% 96.00%
CHEMBL1951 P21397 Monoamine oxidase A 84.20% 91.49%
CHEMBL5543 Q9Y463 Dual specificity tyrosine-phosphorylation-regulated kinase 1B 83.60% 94.70%
CHEMBL3192 Q9BY41 Histone deacetylase 8 83.01% 93.99%
CHEMBL2373 P21730 C5a anaphylatoxin chemotactic receptor 82.58% 92.62%
CHEMBL2094127 P06493 Cyclin-dependent kinase 1/cyclin B 82.56% 96.00%
CHEMBL1937 Q92769 Histone deacetylase 2 81.37% 94.75%
CHEMBL5311 P37023 Serine/threonine-protein kinase receptor R3 81.36% 82.67%
CHEMBL5339 Q5NUL3 G-protein coupled receptor 120 81.27% 95.78%
CHEMBL2378 P30307 Dual specificity phosphatase Cdc25C 80.46% 96.67%

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.
Pongamia pinnata

Cross-Links

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PubChem 15559466
LOTUS LTS0218344
wikiData Q104395525