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Details

Stereochemistry ACHIRAL
Molecular Formula C21H26NO2.I
Molecular Weight 457.3654
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-DAMP IODIDE H-3

SMILES

[I-].[3H]C([3H])([3H])[N+]1(C)CCC(CC1)OC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChIKey=WWJHRSCUAQPFQO-DFCKGCRZSA-M
InChI=1S/C21H26NO2.HI/c1-22(2)15-13-19(14-16-22)24-21(23)20(17-9-5-3-6-10-17)18-11-7-4-8-12-18;/h3-12,19-20H,13-16H2,1-2H3;1H/q+1;/p-1/i1T3;

HIDE SMILES / InChI

Molecular Formula I
Molecular Weight 126.9045
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C21H26NO2
Molecular Weight 330.461
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:33:43 GMT 2023
Edited
by admin
on Sat Dec 16 19:33:43 GMT 2023
Record UNII
3H32SF8P2V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-DAMP IODIDE H-3
Common Name English
Piperidinium, 4-[(diphenylacetyl)oxy]-1,1-dimethyl-, iodide, labeled with tritium
Common Name English
[H-3]4-DAMP IODIDE
Common Name English
[3H]4-DAMP
Common Name English
Code System Code Type Description
FDA UNII
3H32SF8P2V
Created by admin on Sat Dec 16 19:33:44 GMT 2023 , Edited by admin on Sat Dec 16 19:33:44 GMT 2023
PRIMARY
Related Record Type Details
TARGET->LIGAND
Binding Assay
Kd
NON-LABELED -> LABELED