Benzene, 1,1'-(1,2-ethenediyl)bis-

Details

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Internal ID 0a491511-e6b7-4743-b74f-fb125a94e8f4
Taxonomy Phenylpropanoids and polyketides > Stilbenes
IUPAC Name stilbene
SMILES (Canonical) C1=CC=C(C=C1)C=CC2=CC=CC=C2
SMILES (Isomeric) C1=CC=C(C=C1)C=CC2=CC=CC=C2
InChI InChI=1S/C14H12/c1-3-7-13(8-4-1)11-12-14-9-5-2-6-10-14/h1-12H
InChI Key PJANXHGTPQOBST-UHFFFAOYSA-N
Popularity 1,109 references in papers

Physical and Chemical Properties

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Molecular Formula C14H12
Molecular Weight 180.24 g/mol
Exact Mass 180.093900383 g/mol
Topological Polar Surface Area (TPSA) 0.00 Ų
XlogP 4.80

Synonyms

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Benzene, 1,1'-(1,2-ethenediyl)bis-
Stilben
1,2-Diphenylethene
.alpha.,.beta.-Diphenylethylene
phenylstyrene
MFCD00004788
MFCD00064300
1,2-diphenyl-ethylene
1,2 Diphenyl Ethylene
DTXSID6060424
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of Benzene, 1,1'-(1,2-ethenediyl)bis-

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
CHEMBL2035 P08912 Muscarinic acetylcholine receptor M5 94.11% 94.62%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 90.43% 96.00%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 90.08% 95.56%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 88.07% 91.11%
CHEMBL1293249 Q13887 Kruppel-like factor 5 87.09% 86.33%
CHEMBL1821 P08173 Muscarinic acetylcholine receptor M4 87.03% 94.08%
CHEMBL221 P23219 Cyclooxygenase-1 84.59% 90.17%
CHEMBL3192 Q9BY41 Histone deacetylase 8 83.89% 93.99%
CHEMBL2039 P27338 Monoamine oxidase B 81.30% 92.51%
CHEMBL216 P11229 Muscarinic acetylcholine receptor M1 81.17% 94.23%

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 firma
Alnus sieboldiana
Petiveria alliacea
Pinus taeda

Cross-Links

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PubChem 11502
LOTUS LTS0168572
wikiData Q26990366