Furo(2,3-b)quinolin-7-ol, 4-methoxy-8-(3-methyl-2-butenyl)-

Details

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Internal ID c5b88dbb-33a9-4c98-b720-7bc162138a4b
Taxonomy Organoheterocyclic compounds > Quinolines and derivatives > Furanoquinolines
IUPAC Name 4-methoxy-8-(3-methylbut-2-enyl)furo[2,3-b]quinolin-7-ol
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C17H17NO3/c1-10(2)4-5-11-14(19)7-6-12-15(11)18-17-13(8-9-21-17)16(12)20-3/h4,6-9,19H,5H2,1-3H3
InChI Key IANYLUHPTIWWLS-UHFFFAOYSA-N
Popularity 3 references in papers

Physical and Chemical Properties

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Molecular Formula C17H17NO3
Molecular Weight 283.32 g/mol
Exact Mass 283.12084340 g/mol
Topological Polar Surface Area (TPSA) 55.50 Ų
XlogP 4.50

Synonyms

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107882-26-8
7-Hydroxy-8-(3-methyl-2-butenyl)-4-methoxyfuro(2,3-b)quinoline
4-methoxy-8-(3-methylbut-2-enyl)furo(2,3-b)quinolin-7-ol
4-methoxy-8-(3-methylbut-2-enyl)furo[2,3-b]quinolin-7-ol
RefChem:345892
CHEMBL447095
DTXSID70910566
4-Methoxy-8-(3-methylbut-2-en-1-yl)furo[2,3-b]quinolin-7(9H)-one

2D Structure

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2D Structure of Furo(2,3-b)quinolin-7-ol, 4-methoxy-8-(3-methyl-2-butenyl)-

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 97.91% 91.11%
CHEMBL1951 P21397 Monoamine oxidase A 95.83% 91.49%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 92.62% 94.45%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 90.85% 94.00%
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 90.71% 85.14%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 88.95% 96.00%
CHEMBL3401 O75469 Pregnane X receptor 88.21% 94.73%
CHEMBL1860 P10827 Thyroid hormone receptor alpha 87.73% 99.15%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 87.25% 99.23%
CHEMBL4040 P28482 MAP kinase ERK2 86.06% 83.82%
CHEMBL4306 P22460 Voltage-gated potassium channel subunit Kv1.5 83.67% 94.03%
CHEMBL4224 P49759 Dual specificty protein kinase CLK1 83.11% 85.30%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 83.01% 95.56%
CHEMBL3286 P00749 Urokinase-type plasminogen activator 81.23% 97.88%
CHEMBL3060 Q9Y345 Glycine transporter 2 81.17% 99.17%

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.
Haplophyllum tuberculatum

Cross-Links

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PubChem 135743956
LOTUS LTS0035315
wikiData Q105036201