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Details

Stereochemistry ACHIRAL
Molecular Formula C26H29NO
Molecular Weight 371.5146
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of TAMOXIFEN

SMILES

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

InChI

InChIKey=NKANXQFJJICGDU-QPLCGJKRSA-N
InChI=1S/C26H29NO/c1-4-25(21-11-7-5-8-12-21)26(22-13-9-6-10-14-22)23-15-17-24(18-16-23)28-20-19-27(2)3/h5-18H,4,19-20H2,1-3H3/b26-25-

HIDE SMILES / InChI
Molecular Formula C26H29NO
Molecular Weight 371.5146
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Unknown
86413
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:32:00 UTC 2023
Edited
by admin
on Fri Dec 15 15:32:00 UTC 2023
Record UNII
094ZI81Y45
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TAMOXIFEN
HSDB   INN   MI   VANDF   WHO-DD  
INN  
Official Name English
TAMOXIFEN [HSDB]
Common Name English
TAMOPLEX
Brand Name English
Tamoxifen [WHO-DD]
Common Name English
ICI-47699
Code English
tamoxifen [INN]
Common Name English
NOVALDEX
Brand Name English
NSC-727681
Code English
TAMOXIFEN [IARC]
Common Name English
(Z)-2-(4-(1,2-DIPHENYL-1-BUTENYL)PHENOXY)-N,N-DIMETHYLETHANAMINE
Systematic Name English
ETHANAMINE, 2-(4-((1Z)-1,2-DIPHENYL-1-BUTEN-1-YL)PHENOXY)-N,N-DIMETHYL-
Systematic Name English
TAMOXIFEN [VANDF]
Common Name English
MAMMATON
Brand Name English
TAMOXIFEN [MI]
Common Name English
Classification Tree Code System Code
WHO-ATC L02BA01
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
LIVERTOX NBK548902
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
NCI_THESAURUS C1821
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
NCI_THESAURUS C2089
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
WHO-ESSENTIAL MEDICINES LIST 8.3
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
NDF-RT N0000175826
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
NDF-RT N0000000168
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
WHO-VATC QL02BA01
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
Code System Code Type Description
MERCK INDEX
m10450
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
PRIMARY Merck Index
LACTMED
Tamoxifen
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
PRIMARY
HSDB
6782
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
PRIMARY
INN
3299
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
PRIMARY
EVMPD
SUB10825MIG
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
PRIMARY
FDA UNII
094ZI81Y45
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
PRIMARY
RXCUI
10324
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
PRIMARY RxNorm
EPA CompTox
DTXSID1034187
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
PRIMARY
MESH
D013629
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
PRIMARY
DRUG CENTRAL
2561
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
PRIMARY
DRUG BANK
DB00675
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
PRIMARY
CAS
10540-29-1
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
PRIMARY
NSC
727681
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
PRIMARY
WIKIPEDIA
TAMOXIFEN
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
PRIMARY
ECHA (EC/EINECS)
234-118-0
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
PRIMARY
CHEBI
41774
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
PRIMARY
PUBCHEM
2733526
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
PRIMARY
IUPHAR
1016
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
PRIMARY
DAILYMED
094ZI81Y45
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
PRIMARY
ChEMBL
CHEMBL83
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
PRIMARY
NCI_THESAURUS
C62078
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
PRIMARY
SMS_ID
100000091546
Created by admin on Fri Dec 15 15:32:00 UTC 2023 , Edited by admin on Fri Dec 15 15:32:00 UTC 2023
PRIMARY
Related Record Type Details
CYTOCHROME P450 3A4
METABOLIC ENZYME -> SUBSTRATE
ESTROGEN RECEPTOR
TARGET -> INHIBITOR
Binding Assay
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Structure of TAMOXIFEN CITRATE
SALT/SOLVATE -> PARENT
MULTIDRUG RESISTANCE PROTEIN 1
TRANSPORTER -> INHIBITOR
Structure of TAMOXIFEN HYDROCHLORIDE
SALT/SOLVATE -> PARENT
MULTIDRUG RESISTANCE PROTEIN 1
TARGET -> SUBSTRATE
ALDEHYDE OXIDASE
METABOLIC ENZYME -> INHIBITOR
IC50
CYTOCHROME P450 2D6
METABOLIC ENZYME -> SUBSTRATE
OCT-2
TRANSPORTER -> INHIBITOR
Related Record Type Details
Structure of N-DESMETHYLTAMOXIFEN
METABOLITE ACTIVE -> PARENT
MAJOR
PLASMA
Structure of NORENDOXIFEN
METABOLITE -> PARENT
Structure of 2-(4-((Z)-1,2-DIPHENYLBUT-1-ENYL)PHENOXY)ACETIC ACID
METABOLITE -> PARENT
Structure of HYDROXYTAMOXIFEN
METABOLITE ACTIVE -> PARENT
Structure of 4-HYDROXY-3-METHOXYTAMOXIFEN
METABOLITE -> PARENT
MINOR
URINE
Structure of 2-(4-((Z)-1,2-DIPHENYLBUT-1-ENYL)PHENOXY)ACETALDEHYDE
METABOLITE -> PARENT
Structure of ENDOXIFEN
METABOLITE ACTIVE -> PARENT
MAJOR
PLASMA
Related Record Type Details
Structure of TAMOXIFEN
ACTIVE MOIETY
Name Property Type Amount Referenced Substance Defining Parameters References
Tmax PHARMACOKINETIC ORAL ADMINISTRATION

Biological Half-life PHARMACOKINETIC
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