2-(4-Methoxyphenyl)-5-prop-1-enyl-1-benzofuran

Details

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Internal ID 3745354b-54ac-42e8-ac37-3df787db3900
Taxonomy Phenylpropanoids and polyketides > 2-arylbenzofuran flavonoids
IUPAC Name 2-(4-methoxyphenyl)-5-prop-1-enyl-1-benzofuran
SMILES (Canonical) CC=CC1=CC2=C(C=C1)OC(=C2)C3=CC=C(C=C3)OC
SMILES (Isomeric) CC=CC1=CC2=C(C=C1)OC(=C2)C3=CC=C(C=C3)OC
InChI InChI=1S/C18H16O2/c1-3-4-13-5-10-17-15(11-13)12-18(20-17)14-6-8-16(19-2)9-7-14/h3-12H,1-2H3
InChI Key LCFUYKXYGSJBDG-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C18H16O2
Molecular Weight 264.30 g/mol
Exact Mass 264.115029749 g/mol
Topological Polar Surface Area (TPSA) 22.40 Ų
XlogP 5.00

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 2-(4-Methoxyphenyl)-5-prop-1-enyl-1-benzofuran

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 95.85% 91.11%
CHEMBL1907 P15144 Aminopeptidase N 94.62% 93.31%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 94.62% 96.00%
CHEMBL2487 P05067 Beta amyloid A4 protein 93.74% 96.74%
CHEMBL1293249 Q13887 Kruppel-like factor 5 93.31% 86.33%
CHEMBL4224 P49759 Dual specificty protein kinase CLK1 90.71% 85.30%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 89.46% 95.56%
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 88.59% 85.14%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 88.50% 94.00%
CHEMBL1293294 P51151 Ras-related protein Rab-9A 87.31% 87.67%
CHEMBL4016 P42262 Glutamate receptor ionotropic, AMPA 2 84.60% 86.92%
CHEMBL3959 P16083 Quinone reductase 2 84.60% 89.49%
CHEMBL3091268 Q92753 Nuclear receptor ROR-beta 83.59% 95.50%
CHEMBL2243 O00519 Anandamide amidohydrolase 83.47% 97.53%
CHEMBL3492 P49721 Proteasome Macropain subunit 83.12% 90.24%
CHEMBL1860 P10827 Thyroid hormone receptor alpha 82.95% 99.15%
CHEMBL1293277 O15118 Niemann-Pick C1 protein 82.51% 81.11%
CHEMBL4769 O95749 Geranylgeranyl pyrophosphate synthetase 82.38% 92.08%
CHEMBL2288 Q13526 Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 82.31% 91.71%
CHEMBL4208 P20618 Proteasome component C5 82.23% 90.00%
CHEMBL1907599 P05556 Integrin alpha-4/beta-1 82.22% 92.86%
CHEMBL3401 O75469 Pregnane X receptor 81.71% 94.73%
CHEMBL2581 P07339 Cathepsin D 80.81% 98.95%
CHEMBL5409 Q8TDU6 G-protein coupled bile acid receptor 1 80.05% 93.65%

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.
Krameria bicolor
Krameria erecta
Krameria lappacea

Cross-Links

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PubChem 129650689
LOTUS LTS0180684
wikiData Q105149806