4-[3-(5-Hydroxy-2-methoxyphenyl)propyl]-2-methoxyphenol

Details

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Internal ID 680f17ae-bf47-4269-9375-68f3ccb4f221
Taxonomy Phenylpropanoids and polyketides > Linear 1,3-diarylpropanoids > Cinnamylphenols
IUPAC Name 4-[3-(5-hydroxy-2-methoxyphenyl)propyl]-2-methoxyphenol
SMILES (Canonical) COC1=C(C=C(C=C1)O)CCCC2=CC(=C(C=C2)O)OC
SMILES (Isomeric) COC1=C(C=C(C=C1)O)CCCC2=CC(=C(C=C2)O)OC
InChI InChI=1S/C17H20O4/c1-20-16-9-7-14(18)11-13(16)5-3-4-12-6-8-15(19)17(10-12)21-2/h6-11,18-19H,3-5H2,1-2H3
InChI Key GDFQDNKQRITJNI-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C17H20O4
Molecular Weight 288.34 g/mol
Exact Mass 288.13615911 g/mol
Topological Polar Surface Area (TPSA) 58.90 Ų
XlogP 3.90

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 4-[3-(5-Hydroxy-2-methoxyphenyl)propyl]-2-methoxyphenol

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 96.96% 91.11%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 96.94% 96.09%
CHEMBL2581 P07339 Cathepsin D 94.35% 98.95%
CHEMBL3060 Q9Y345 Glycine transporter 2 94.22% 99.17%
CHEMBL1255126 O15151 Protein Mdm4 92.78% 90.20%
CHEMBL1293249 Q13887 Kruppel-like factor 5 91.93% 86.33%
CHEMBL335 P18031 Protein-tyrosine phosphatase 1B 91.92% 95.17%
CHEMBL1966 Q02127 Dihydroorotate dehydrogenase 90.65% 96.09%
CHEMBL2535 P11166 Glucose transporter 88.23% 98.75%
CHEMBL225 P28335 Serotonin 2c (5-HT2c) receptor 87.11% 89.62%
CHEMBL3194 P02766 Transthyretin 85.78% 90.71%
CHEMBL1907603 Q05586 Glutamate NMDA receptor; GRIN1/GRIN2B 84.63% 95.89%
CHEMBL4793 Q86TI2 Dipeptidyl peptidase IX 84.62% 96.95%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 83.76% 94.45%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 83.75% 94.00%
CHEMBL5608 Q16288 NT-3 growth factor receptor 83.33% 95.89%
CHEMBL4208 P20618 Proteasome component C5 82.27% 90.00%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 80.96% 95.56%

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.
Broussonetia papyrifera

Cross-Links

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PubChem 162971055
LOTUS LTS0030400
wikiData Q105006688