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4-Hydroxy-N-desmethyltamoxifen

Properties

Image

Occurences in reactions

MNX_ID

MNXM6109

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	0

formula

C₂₅H₂₇NO₂

charge

mass

373.20418

reference

InChIKey

MHJBZVSGOZTKRH-IZHYLOQSSA-N

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-

SMILES

CC/C(=C(\c1ccc(O)cc1)c1ccc(OCCNC)cc1)c1ccccc1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:80555 chebi:80555	4-Hydroxy-N-desmethyltamoxifen Endoxifen
hmdb:HMDB0060666	Endoxifen 4-Hydroxy-N-demethyltamoxifen 4-Hydroxy-N-desmethyltamoxifen 4-Hydroxy-N-desmethyltamoxifen, (Z)-isomer 4-[(1Z)-1-{4-[2-(methylamino)ethoxy]phenyl}-2-phenylbut-1-en-1-yl]phenol Z-Endoxifen endoxifen
seed.compound:cpd16361 seedM:cpd16361 kegg.compound:C16547 keggC:C16547	Endoxifen 4-Hydroxy-N-desmethyltamoxifen
metacyc.compound:CPD-23695 metacycM:CPD-23695	endoxifen 4-hydroxy-N-desmethyltamoxifen N-desmethyl-4-hydroxytamoxifen
hmdb:HMDB60666 keggC:M_C16547 seedM:M_cpd16361	secondary/obsolete/fantasy identifier