U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C25H27NO
Molecular Weight 357.488
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of N-DESMETHYLTAMOXIFEN

SMILES

CC\C(=C(/C1=CC=CC=C1)C2=CC=C(OCCNC)C=C2)C3=CC=CC=C3

InChI

InChIKey=NYDCDZSEEAUOHN-IZHYLOQSSA-N
InChI=1S/C25H27NO/c1-3-24(20-10-6-4-7-11-20)25(21-12-8-5-9-13-21)22-14-16-23(17-15-22)27-19-18-26-2/h4-17,26H,3,18-19H2,1-2H3/b25-24-

HIDE SMILES / InChI

Molecular Formula C25H27NO
Molecular Weight 357.488
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:13:40 UTC 2023
Edited
by admin
on Fri Dec 15 19:13:40 UTC 2023
Record UNII
OOJ759O35C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-DESMETHYLTAMOXIFEN
Common Name English
2-(4-((Z)-1,2-DIPHENYLBUT-1-ENYL)PHENOXY)-N-METHYLETHANAMINE
Systematic Name English
DEMETHYLTAMOXIFEN
Common Name English
ETHANAMINE, 2-(4-((1Z)-1,2-DIPHENYL-1-BUTEN-1-YL)PHENOXY)-N-METHYL-
Systematic Name English
DESMETHYLTAMOXIFEN
Common Name English
ICI-55548
Code English
TAMOXIFEN CITRATE IMPURITY F [EP IMPURITY]
Common Name English
DESMETHYLTAMOXIFEN, N-
Common Name English
N-DEMETHYLTAMOXIFEN
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C2163
Created by admin on Fri Dec 15 19:13:40 UTC 2023 , Edited by admin on Fri Dec 15 19:13:40 UTC 2023
Code System Code Type Description
WIKIPEDIA
N-Desmethyltamoxifen
Created by admin on Fri Dec 15 19:13:40 UTC 2023 , Edited by admin on Fri Dec 15 19:13:40 UTC 2023
PRIMARY
PUBCHEM
6378383
Created by admin on Fri Dec 15 19:13:40 UTC 2023 , Edited by admin on Fri Dec 15 19:13:40 UTC 2023
PRIMARY
NCI_THESAURUS
C64189
Created by admin on Fri Dec 15 19:13:40 UTC 2023 , Edited by admin on Fri Dec 15 19:13:40 UTC 2023
PRIMARY
FDA UNII
OOJ759O35C
Created by admin on Fri Dec 15 19:13:40 UTC 2023 , Edited by admin on Fri Dec 15 19:13:40 UTC 2023
PRIMARY
CAS
31750-48-8
Created by admin on Fri Dec 15 19:13:40 UTC 2023 , Edited by admin on Fri Dec 15 19:13:40 UTC 2023
PRIMARY
EPA CompTox
DTXSID501315924
Created by admin on Fri Dec 15 19:13:40 UTC 2023 , Edited by admin on Fri Dec 15 19:13:40 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE ACTIVE
MAJOR
PLASMA
Related Record Type Details
PARENT -> IMPURITY
not more than 3 times the area of the principal peak in the chromatogram obtained with reference solution (b)
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP