CHEBI:3641 - chlorotrianisene

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ChEBI Name chlorotrianisene
ChEBI ID CHEBI:3641
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C23H21ClO3
Net Charge 0
Average Mass 380.86374
Monoisotopic Mass 380.11792
InChI InChI=1S/C23H21ClO3/c1-25-19-10-4-16(5-11-19)22(17-6-12-20(26-2)13-7-17)23(24)18-8-14-21(27-3)15-9-18/h4-15H,1-3H3
InChIKey BFPSDSIWYFKGBC-UHFFFAOYSA-N
SMILES COc1ccc(cc1)C(Cl)=C(c1ccc(OC)cc1)c1ccc(OC)cc1
Roles Classification
Biological Role(s): xenoestrogen
A synthetic or semi-synthetic compound that has oestrogenic activity.
Application(s): estrogen receptor modulator
A substance that possess antiestrogenic actions but can also produce estrogenic effects as well. It acts as complete or partial agonist or as antagonist. It can be either steroidal or nonsteroidal in structure.
antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
xenoestrogen
A synthetic or semi-synthetic compound that has oestrogenic activity.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing chlorotrianisene (CHEBI:3641) has parent hydride stilbene (CHEBI:26775)
chlorotrianisene (CHEBI:3641) has role antineoplastic agent (CHEBI:35610)
chlorotrianisene (CHEBI:3641) has role estrogen receptor modulator (CHEBI:50739)
chlorotrianisene (CHEBI:3641) has role xenoestrogen (CHEBI:76988)
chlorotrianisene (CHEBI:3641) is a chloroalkene (CHEBI:36387)
IUPAC Name
1,1',1''-(2-chloroethene-1,1,2-triyl)tris(4-methoxybenzene)
INNs Sources
chlorotrianisène ChEBI
chlorotrianisene ChEBI
chlorotrianisenum ChEBI
clorotrianiseno ChEBI
Synonyms Sources
Chloortrianisestrol DrugBank
Chlorestrolo DrugBank
Chlorotrianisine DrugBank
Chlorotrianizen DrugBank
Chlortrianisen DrugBank
Chlortrianisestrol DrugBank
Chlortrianisoestrolum DrugBank
Chlortrianizen DrugBank
Manual Xrefs Databases
610 DrugCentral
Chlorotrianisene Wikipedia
D00269 KEGG DRUG
DB00269 DrugBank
GB561508 Patent
LSM-5411 LINCS
US2430891 Patent
View more database links
Registry Numbers Types Sources
1891845 Beilstein Registry Number Beilstein
569-57-3 CAS Registry Number ChemIDplus
Last Modified
22 February 2017