4-[2-(2-Methoxy-5-prop-1-enylphenyl)prop-2-enyl]phenol

Details

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Internal ID 7ac96e1a-f648-499b-bed2-93441de63a77
Taxonomy Phenylpropanoids and polyketides > Stilbenes
IUPAC Name 4-[2-(2-methoxy-5-prop-1-enylphenyl)prop-2-enyl]phenol
SMILES (Canonical) CC=CC1=CC(=C(C=C1)OC)C(=C)CC2=CC=C(C=C2)O
SMILES (Isomeric) CC=CC1=CC(=C(C=C1)OC)C(=C)CC2=CC=C(C=C2)O
InChI InChI=1S/C19H20O2/c1-4-5-15-8-11-19(21-3)18(13-15)14(2)12-16-6-9-17(20)10-7-16/h4-11,13,20H,2,12H2,1,3H3
InChI Key RKXBXYXVNGUVCT-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C19H20O2
Molecular Weight 280.40 g/mol
Exact Mass 280.146329876 g/mol
Topological Polar Surface Area (TPSA) 29.50 Ų
XlogP 5.50

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 4-[2-(2-Methoxy-5-prop-1-enylphenyl)prop-2-enyl]phenol

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
CHEMBL1293249 Q13887 Kruppel-like factor 5 94.61% 86.33%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 93.99% 96.09%
CHEMBL1255126 O15151 Protein Mdm4 93.71% 90.20%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 93.02% 91.11%
CHEMBL2581 P07339 Cathepsin D 92.01% 98.95%
CHEMBL3060 Q9Y345 Glycine transporter 2 91.76% 99.17%
CHEMBL3091268 Q92753 Nuclear receptor ROR-beta 90.86% 95.50%
CHEMBL2535 P11166 Glucose transporter 89.58% 98.75%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 89.39% 96.00%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 89.37% 94.45%
CHEMBL1951 P21397 Monoamine oxidase A 88.81% 91.49%
CHEMBL2288 Q13526 Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 88.45% 91.71%
CHEMBL3492 P49721 Proteasome Macropain subunit 88.01% 90.24%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 87.75% 95.56%
CHEMBL3194 P02766 Transthyretin 87.67% 90.71%
CHEMBL5608 Q16288 NT-3 growth factor receptor 86.01% 95.89%
CHEMBL5939 Q9NZ08 Endoplasmic reticulum aminopeptidase 1 84.79% 100.00%
CHEMBL1907603 Q05586 Glutamate NMDA receptor; GRIN1/GRIN2B 84.41% 95.89%
CHEMBL4793 Q86TI2 Dipeptidyl peptidase IX 83.84% 96.95%
CHEMBL4208 P20618 Proteasome component C5 81.38% 90.00%
CHEMBL4657 Q6V1X1 Dipeptidyl peptidase VIII 81.07% 97.21%

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 ramosissima

Cross-Links

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PubChem 162987643
LOTUS LTS0242846
wikiData Q105239571