CHEBI:4518 - dienestrol

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ChEBI Name dienestrol
ChEBI ID CHEBI:4518
Definition An olefinic compound that is hexa-2,4-diene substituted by 4-hydroxyphenyl groups at positions 3 and 4 respectively.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C18H18O2
Net Charge 0
Average Mass 266.33432
Monoisotopic Mass 266.13068
InChI InChI=1S/C18H18O2/c1-3-17(13-5-9-15(19)10-6-13)18(4-2)14-7-11-16(20)12-8-14/h3-12,19-20H,1-2H3
InChIKey NFDFQCUYFHCNBW-UHFFFAOYSA-N
SMILES CC=C(c1ccc(O)cc1)C(=CC)c1ccc(O)cc1
Roles Classification
Biological Role(s): xenoestrogen
A synthetic or semi-synthetic compound that has oestrogenic activity.
Application(s): xenoestrogen
A synthetic or semi-synthetic compound that has oestrogenic activity.
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ChEBI Ontology
Outgoing dienestrol (CHEBI:4518) has role xenoestrogen (CHEBI:76988)
dienestrol (CHEBI:4518) is a olefinic compound (CHEBI:78840)
dienestrol (CHEBI:4518) is a phenols (CHEBI:33853)
IUPAC Name
4,4'-hexa-2,4-diene-3,4-diyldiphenol
INN Source
dienestrol KEGG DRUG
Synonyms Sources
4,4'-Hydroxy-γ,δ-diphenyl-β,δ-hexadiene NIST Chemistry WebBook
Dehydrostilbestrol KEGG COMPOUND
Di(p-oxyphenyl)-2,4-hexadiene NIST Chemistry WebBook
Dienestrol KEGG COMPOUND
p,p'-(Diethylideneethylene)diphenol NIST Chemistry WebBook
Manual Xrefs Databases
C08090 KEGG COMPOUND
D00898 KEGG DRUG
DB00890 DrugBank
Dienestrol Wikipedia
LSM-4142 LINCS
US2464203 Patent
US2465505 Patent
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Registry Numbers Types Sources
2053692 Reaxys Registry Number Reaxys
84-17-3 CAS Registry Number ChemIDplus
84-17-3 CAS Registry Number NIST Chemistry WebBook
Citations Waiting for Citations Types Sources
18275104 PubMed citation Europe PMC
25188907 PubMed citation Europe PMC
Last Modified
22 February 2017