Velloquercetin 3,3',4'-trimethyl ether

Details

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Internal ID 16e73091-6c3c-4d28-99c8-396fe20d8f5e
Taxonomy Phenylpropanoids and polyketides > Flavonoids > Flavones > 6-prenylated flavones
IUPAC Name 7-(3,4-dimethoxyphenyl)-4-hydroxy-6-methoxy-2-prop-1-en-2-yl-2,3-dihydrofuro[3,2-g]chromen-5-one
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C23H22O7/c1-11(2)15-9-13-16(29-15)10-18-19(20(13)24)21(25)23(28-5)22(30-18)12-6-7-14(26-3)17(8-12)27-4/h6-8,10,15,24H,1,9H2,2-5H3
InChI Key DOLRPGHVVKBWMY-UHFFFAOYSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C23H22O7
Molecular Weight 410.40 g/mol
Exact Mass 410.13655304 g/mol
Topological Polar Surface Area (TPSA) 83.50 Ų
XlogP 4.80

Synonyms

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LMPK12112766

2D Structure

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2D Structure of Velloquercetin 3,3',4'-trimethyl ether

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 97.06% 91.11%
CHEMBL1806 P11388 DNA topoisomerase II alpha 95.25% 89.00%
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 95.21% 85.14%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 95.04% 94.00%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 94.84% 94.45%
CHEMBL1293249 Q13887 Kruppel-like factor 5 93.62% 86.33%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 93.30% 96.09%
CHEMBL2581 P07339 Cathepsin D 93.12% 98.95%
CHEMBL241 Q14432 Phosphodiesterase 3A 88.89% 92.94%
CHEMBL5608 Q16288 NT-3 growth factor receptor 87.10% 95.89%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 86.75% 95.56%
CHEMBL217 P14416 Dopamine D2 receptor 86.30% 95.62%
CHEMBL5339 Q5NUL3 G-protein coupled receptor 120 85.49% 95.78%
CHEMBL3830 Q2M2I8 Adaptor-associated kinase 85.12% 83.10%
CHEMBL3060 Q9Y345 Glycine transporter 2 83.94% 99.17%
CHEMBL3438 Q05513 Protein kinase C zeta 83.45% 88.48%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 82.96% 99.23%
CHEMBL4306 P22460 Voltage-gated potassium channel subunit Kv1.5 82.28% 94.03%
CHEMBL4940 P07195 L-lactate dehydrogenase B chain 81.38% 95.53%
CHEMBL4478 Q00975 Voltage-gated N-type calcium channel alpha-1B subunit 80.80% 97.14%
CHEMBL5845 P23415 Glycine receptor subunit alpha-1 80.60% 90.71%

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.
Vellozia stipitata

Cross-Links

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PubChem 15126641
LOTUS LTS0078268
wikiData Q104986045