loading...| Preferred Name |
Chlorotrianisene |
|
| Synonyms |
1,1',1''-(2-chloroethene-1,1,2-triyl)tris(4-methoxybenzene) Chlorestrolo Chlorotrianisine Chlortrianizen Chlortrianisestrol Chlortrianisen clorotrianiseno Chlorotrianizen Chloortrianisestrol chlorotrianisene chlorotrianisenum Chlortrianisoestrolum |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_3641 |
|
| charge |
0 |
|
| database_cross_reference |
Drug_Central:610 KEGG:D00269 Patent:US2430891 Patent:GB561508 DrugBank:DB00269 Wikipedia:Chlorotrianisene CAS:569-57-3 LINCS:LSM-5411 Beilstein:1891845 |
|
| formula |
C23H21ClO3 |
|
| has parent hydride | ||
| has role |
http://purl.obolibrary.org/obo/CHEBI_35610 |
|
| has_exact_synonym |
1,1',1''-(2-chloroethene-1,1,2-triyl)tris(4-methoxybenzene) |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
Chlorestrolo Chlorotrianisine Chlortrianizen Chlortrianisestrol Chlortrianisen clorotrianiseno Chlorotrianizen Chloortrianisestrol chlorotrianisene chlorotrianisenum Chlortrianisoestrolum |
|
| has_RxCUI |
2397 |
|
| id |
CHEBI:3641 |
|
| in_subset | ||
| 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 |
|
| label |
chlorotrianisene Chlorotrianisene |
|
| mass |
380.86374 |
|
| monoisotopicmass |
380.11792 |
|
| notation |
CHEBI:3641 |
|
| prefixIRI |
CHEBI:3641 |
|
| prefLabel |
Chlorotrianisene |
|
| smiles |
COc1ccc(cc1)C(Cl)=C(c1ccc(OC)cc1)c1ccc(OC)cc1 |
|
| subClassOf |