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N-Desmethyltamoxifen

CAT: 0957-E0786Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0957-E0786Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
N-Desmethyltamoxifen, the major metabolite of Tamoxifen in humans and a ten-fold more potent protein kinase C (PKC) inhibitor than Tamoxifen, also is a potent regulator of ceramide metabolism in human AML cells, limiting ceramide glycosylation, hydrolysis, and sphingosine phosphorylation.
CAS Number
31750-48-8
Target
PKC
Activity
Cytoskeletal Signaling
Molecular Formula
C25H27NO
Storage Conditions
3 years -20°C powder

Chemical Information

Desmethyltamoxifen

N-Desmethyltamoxifen is a stilbenoid.

CAS Number31750-48-8
PubChem CID6378383
IUPAC Name2-[4-[(Z)-1,2-diphenylbut-1-enyl]phenoxy]-N-methylethanamine
Molecular FormulaC25H27NO
Molecular Weight357.5
XLogP6.7
Topological Polar Surface Area21.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count8
Heavy Atom Count27
Formal Charge0
Complexity437
SMILES
CC/C(=C(\C1=CC=CC=C1)/C2=CC=C(C=C2)OCCNC)/C3=CC=CC=C3
InChI
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-
InChIKey
NYDCDZSEEAUOHN-IZHYLOQSSA-N
Chemical Structure
2D Structure
2D structure of Desmethyltamoxifen
CAS: 31750-48-8
CID: 6378383
Formula: C25H27NO
MW: 357.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight357.5
XLogP36.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count8
Exact Mass357.209264485
Monoisotopic Mass357.209264485
Topological Polar Surface Area21.3 Ų
Heavy Atom Count27
Formal Charge0
Complexity437
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
GTR19229699-01N-Desmethyltamoxifen
T12148-01N-Desmethyltamoxifen hydrochloride
HY-129099A-01N-Desmethyltamoxifen (hydrochloride)
HY-129099AR-01N-Desmethyltamoxifen (hydrochloride) (Standard)
D3220-90NN-Desmethyltamoxifen Methanethiosulfonate Hydrobromide
CS-P-09209N-DesmethylTamoxifen (E/Z mixture)
CS-O-55644(E) -N-desmethyltamoxifen-4-O-glucuronide
MBS6044133-01N-Desmethyltamoxifen-ethyl-d5 (N-Demethyltamoxifen-ethyl-d5)
D3220-90MN-Desmethyltamoxifen, Hydrochloride (N-Demethyltamoxifen, Hydrochloride_x000B_ (Z) -2-[4- (1,2-Diphenyl-1-butenyl) phenoxy]-N-methyl-ethanamine)
MBS6090073-01N-Desmethyltamoxifen, Hydrochloride (N-Demethyltamoxifen, Hydrochloride(Z)-2-[4-(1,2-Diphenyl-1-butenyl)phenoxy]-N-methyl-ethanamine)

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