CHEBI:80555 - 4-Hydroxy-N-desmethyltamoxifen

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 4-Hydroxy-N-desmethyltamoxifen
ChEBI ID CHEBI:80555
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C25H27NO2
Net Charge 0
Average Mass 373.48740
Monoisotopic Mass 373.20418
InChI InChI=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-
InChIKey MHJBZVSGOZTKRH-IZHYLOQSSA-N
SMILES CC\C(c1ccccc1)=C(/c1ccc(O)cc1)c1ccc(OCCNC)cc1
ChEBI Ontology
Outgoing 4-Hydroxy-N-desmethyltamoxifen (CHEBI:80555) is a stilbenoid (CHEBI:26776)
Synonym Source
Endoxifen KEGG COMPOUND
Manual Xrefs Databases
C16547 KEGG COMPOUND
HMDB0060666 HMDB
View more database links
Registry Number Type Source
112093-28-4 CAS Registry Number KEGG COMPOUND