5-Styrylresorcinol

Details

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Internal ID a426377e-79e4-4aac-816f-5e513821f6a2
Taxonomy Phenylpropanoids and polyketides > Stilbenes
IUPAC Name 5-(2-phenylethenyl)benzene-1,3-diol
SMILES (Canonical) C1=CC=C(C=C1)C=CC2=CC(=CC(=C2)O)O
SMILES (Isomeric) C1=CC=C(C=C1)C=CC2=CC(=CC(=C2)O)O
InChI InChI=1S/C14H12O2/c15-13-8-12(9-14(16)10-13)7-6-11-4-2-1-3-5-11/h1-10,15-16H
InChI Key YCVPRTHEGLPYPB-UHFFFAOYSA-N
Popularity 64 references in papers

Physical and Chemical Properties

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Molecular Formula C14H12O2
Molecular Weight 212.24 g/mol
Exact Mass 212.083729621 g/mol
Topological Polar Surface Area (TPSA) 40.50 Ų
XlogP 3.50

Synonyms

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3,5-Dihydroxystilbene
5-(2-phenylethenyl)benzene-1,3-diol
5-(2-phenylethenyl)-1,3-benzenediol
Spectrum_000651
Resorcinol, 5-styryl-
SpecPlus_000075
Spectrum2_000193
Spectrum3_000197
Spectrum4_001514
KBioGR_002207
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of 5-Styrylresorcinol

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 96.62% 91.11%
CHEMBL2035 P08912 Muscarinic acetylcholine receptor M5 94.95% 94.62%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 93.48% 95.56%
CHEMBL1293249 Q13887 Kruppel-like factor 5 92.24% 86.33%
CHEMBL3194 P02766 Transthyretin 90.62% 90.71%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 90.23% 96.00%
CHEMBL1821 P08173 Muscarinic acetylcholine receptor M4 86.11% 94.08%
CHEMBL2288 Q13526 Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 85.62% 91.71%
CHEMBL3401 O75469 Pregnane X receptor 81.96% 94.73%
CHEMBL2581 P07339 Cathepsin D 81.69% 98.95%
CHEMBL1951 P21397 Monoamine oxidase A 80.70% 91.49%

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.
Alnus pendula
Alnus sieboldiana
Cryptocarya obovata
Helichrysum chionosphaerum
Nothofagus fusca
Pinus ponderosa
Pinus radiata
Pinus sibirica
Pinus sylvestris
Vitis vinifera

Cross-Links

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PubChem 100754
LOTUS LTS0183107
wikiData Q23820208