EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:80555 - 4-Hydroxy-N-desmethyltamoxifen

Default Structure
ChEBI IDCHEBI:80555
ChEBI Name4-Hydroxy-N-desmethyltamoxifen
Stars
DownloadsMolfile
FormulaC25H27NO2
Net Charge0
Average Mass373.496
Monoisotopic Mass373.20418
SMILESCC/C(=C(\c1ccc(O)cc1)c1ccc(OCCNC)cc1)c1ccccc1
InChIInChI=1S/C25H27NO2/c1-3-24(19-7-5-4-6-8-19)25(20-9-13-22(27)14-10-20)21-11-15-23(16-12-21)28-18-17-26-2/h4-16,26-27H,3,17-18H2,1-2H3/b25-24-
InChIKeyMHJBZVSGOZTKRH-IZHYLOQSSA-N
Roles Classification
Applications:
antipsychotic agent  Antipsychotic drugs are agents that control agitated psychotic behaviour, alleviate acute psychotic states, reduce psychotic symptoms, and exert a quieting effect.
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
4-Hydroxy-N-desmethyltamoxifen (CHEBI:80555) has role antineoplastic agent (CHEBI:35610)
4-Hydroxy-N-desmethyltamoxifen (CHEBI:80555) has role antipsychotic agent (CHEBI:35476)
4-Hydroxy-N-desmethyltamoxifen (CHEBI:80555) is a stilbenoid (CHEBI:26776)
Synonyms  Source
4-hydroxy-n-desmethyltamoxifenChEMBL
endoxifenChEMBL
EndoxifenKEGG COMPOUND
N-desmethyl-4-hydroxytamoxifenChEMBL
NSC-749798ChEMBL
Z-endoxifenChEMBL
Manual XrefsDatabases
C16547KEGG COMPOUND
HMDB0060666HMDB
Registry NumbersSources
CAS:112093-28-4KEGG COMPOUND
Citations