(Z)-3-(2,4-dihydroxyphenyl)-1-(4-hydroxyphenyl)prop-2-en-1-one

Details

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Internal ID 919dbf5a-9b68-4ae6-9c80-c6c6dd66e6ea
Taxonomy Phenylpropanoids and polyketides > Linear 1,3-diarylpropanoids > Chalcones and dihydrochalcones > Retrochalcones
IUPAC Name (Z)-3-(2,4-dihydroxyphenyl)-1-(4-hydroxyphenyl)prop-2-en-1-one
SMILES (Canonical) C1=CC(=CC=C1C(=O)C=CC2=C(C=C(C=C2)O)O)O
SMILES (Isomeric) C1=CC(=CC=C1C(=O)/C=C\C2=C(C=C(C=C2)O)O)O
InChI InChI=1S/C15H12O4/c16-12-5-1-10(2-6-12)14(18)8-4-11-3-7-13(17)9-15(11)19/h1-9,16-17,19H/b8-4-
InChI Key VDYSHUXENHRSOO-YWEYNIOJSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C15H12O4
Molecular Weight 256.25 g/mol
Exact Mass 256.07355886 g/mol
Topological Polar Surface Area (TPSA) 77.80 Ų
XlogP 2.60

Synonyms

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SCHEMBL21446884

2D Structure

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2D Structure of (Z)-3-(2,4-dihydroxyphenyl)-1-(4-hydroxyphenyl)prop-2-en-1-one

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
CHEMBL3194 P02766 Transthyretin 96.90% 90.71%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 96.51% 91.11%
CHEMBL4208 P20618 Proteasome component C5 91.10% 90.00%
CHEMBL1293249 Q13887 Kruppel-like factor 5 91.07% 86.33%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 89.12% 95.56%
CHEMBL3192 Q9BY41 Histone deacetylase 8 88.83% 93.99%
CHEMBL1806 P11388 DNA topoisomerase II alpha 85.78% 89.00%
CHEMBL3060 Q9Y345 Glycine transporter 2 85.61% 99.17%
CHEMBL2288 Q13526 Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 84.10% 91.71%
CHEMBL242 Q92731 Estrogen receptor beta 83.62% 98.35%
CHEMBL2535 P11166 Glucose transporter 81.68% 98.75%
CHEMBL5852 Q96P65 Pyroglutamylated RFamide peptide receptor 81.02% 85.00%
CHEMBL4657 Q6V1X1 Dipeptidyl peptidase VIII 80.39% 97.21%
CHEMBL2581 P07339 Cathepsin D 80.35% 98.95%

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.
Dracaena draco

Cross-Links

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PubChem 32953864
LOTUS LTS0239112
wikiData Q105284451