(Z)-4-Methoxy-3,3',5,5'-tetrahydroxystilbene

Details

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Internal ID 559c9ed2-9ceb-4b1c-96a5-c61dc2fde304
Taxonomy Phenylpropanoids and polyketides > Stilbenes
IUPAC Name 5-[(Z)-2-(3,5-dihydroxyphenyl)ethenyl]-2-methoxybenzene-1,3-diol
SMILES (Canonical) COC1=C(C=C(C=C1O)C=CC2=CC(=CC(=C2)O)O)O
SMILES (Isomeric) COC1=C(C=C(C=C1O)/C=C\C2=CC(=CC(=C2)O)O)O
InChI InChI=1S/C15H14O5/c1-20-15-13(18)6-10(7-14(15)19)3-2-9-4-11(16)8-12(17)5-9/h2-8,16-19H,1H3/b3-2-
InChI Key BKJYMZRGLINXRP-IHWYPQMZSA-N
Popularity 1 reference in papers

Physical and Chemical Properties

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Molecular Formula C15H14O5
Molecular Weight 274.27 g/mol
Exact Mass 274.08412354 g/mol
Topological Polar Surface Area (TPSA) 90.20 Ų
XlogP 2.70

Synonyms

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5-[(Z)-2-(3,5-dihydroxyphenyl)ethenyl]-2-methoxybenzene-1,3-diol
3,3',5,5'-tetrahydroxy-4-methoxystilbene
CHEBI:174600
4-Methoxy-3,3',5,5'-tetrahydroxystilbene
cis-3,5,3',5'-tetrahydroxy-4-methoxystilbene
5-[2-(3,5-Dihydroxyphenyl)ethenyl]-2-methoxy-1,3-benzenediol

2D Structure

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2D Structure of (Z)-4-Methoxy-3,3',5,5'-tetrahydroxystilbene

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 97.31% 91.11%
CHEMBL3194 P02766 Transthyretin 91.23% 90.71%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 89.12% 96.00%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 86.55% 95.56%
CHEMBL215 P09917 Arachidonate 5-lipoxygenase 86.52% 92.68%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 86.32% 96.09%
CHEMBL1293249 Q13887 Kruppel-like factor 5 85.26% 86.33%
CHEMBL3060 Q9Y345 Glycine transporter 2 81.93% 99.17%
CHEMBL3401 O75469 Pregnane X receptor 81.29% 94.73%
CHEMBL4208 P20618 Proteasome component C5 81.22% 90.00%

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.
Phoenix dactylifera
Polygonatum orientale

Cross-Links

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PubChem 13499471
LOTUS LTS0131462
wikiData Q104201264