Sanggenofuran B

Details

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Internal ID 2c66621b-178e-48e2-a3f2-280cc9ba7e56
Taxonomy Phenylpropanoids and polyketides > 2-arylbenzofuran flavonoids
IUPAC Name 5-(6-methoxy-1-benzofuran-2-yl)-2-(3-methylbut-2-enyl)benzene-1,3-diol
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C20H20O4/c1-12(2)4-7-16-17(21)8-14(9-18(16)22)19-10-13-5-6-15(23-3)11-20(13)24-19/h4-6,8-11,21-22H,7H2,1-3H3
InChI Key JCWAZFVQFSNZQI-UHFFFAOYSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C20H20O4
Molecular Weight 324.40 g/mol
Exact Mass 324.13615911 g/mol
Topological Polar Surface Area (TPSA) 62.80 Ų
XlogP 5.20

Synonyms

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1017277-40-5
5-(6-methoxy-1-benzofuran-2-yl)-2-(3-methylbut-2-enyl)benzene-1,3-diol
HY-N9067
AKOS040762294
CS-0149632
F92747

2D Structure

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2D Structure of Sanggenofuran B

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 99.22% 91.11%
CHEMBL4224 P49759 Dual specificty protein kinase CLK1 93.99% 85.30%
CHEMBL1860 P10827 Thyroid hormone receptor alpha 93.44% 99.15%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 92.93% 94.00%
CHEMBL3401 O75469 Pregnane X receptor 90.94% 94.73%
CHEMBL3060 Q9Y345 Glycine transporter 2 88.88% 99.17%
CHEMBL2581 P07339 Cathepsin D 88.85% 98.95%
CHEMBL3959 P16083 Quinone reductase 2 88.67% 89.49%
CHEMBL1293249 Q13887 Kruppel-like factor 5 88.50% 86.33%
CHEMBL4016 P42262 Glutamate receptor ionotropic, AMPA 2 87.18% 86.92%
CHEMBL4208 P20618 Proteasome component C5 85.92% 90.00%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 84.38% 96.00%
CHEMBL1951 P21397 Monoamine oxidase A 83.08% 91.49%
CHEMBL4793 Q86TI2 Dipeptidyl peptidase IX 82.89% 96.95%
CHEMBL3492 P49721 Proteasome Macropain subunit 80.19% 90.24%

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.
Morus cathayana

Cross-Links

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PubChem 131843029
LOTUS LTS0025145
wikiData Q105125172