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Details

Stereochemistry ABSOLUTE
Molecular Formula 6C6H8N3O2.C4H6NO4.Cu.Zn.3H.H2O
Molecular Weight 1206.969
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SUPEROXIDE DISMUTASE (CU-ZN) ACTIVE SITE

SMILES

[H+].[H+].[H+].O.[Cu++].[Zn++].N[C@@H](CC([O-])=O)C(O)=O.N[C@@H](CC1=C[N-]C=N1)C(O)=O.N[C@@H](CC2=C[N-]C=N2)C(O)=O.N[C@@H](CC3=C[N-]C=N3)C(O)=O.N[C@@H](CC4=C[N-]C=N4)C(O)=O.N[C@@H](CC5=C[N-]C=N5)C(O)=O.N[C@@H](CC6=C[N-]C=N6)C(O)=O

InChI

InChIKey=SJJHRNIBQUEGJO-UNYMEAMNSA-J
InChI=1S/6C6H9N3O2.C4H7NO4.Cu.H2O.Zn/c6*7-5(6(10)11)1-4-2-8-3-9-4;5-2(4(8)9)1-3(6)7;;;/h6*2-3,5H,1,7H2,(H2,8,9,10,11);2H,1,5H2,(H,6,7)(H,8,9);;1H2;/q;;;;;;;+2;;+2/p-4/t6*5-;2-;;;/m0000000.../s1

HIDE SMILES / InChI

Molecular Formula Cu
Molecular Weight 63.546
Charge 2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula HO
Molecular Weight 17.0073
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C6H9N3O2
Molecular Weight 155.1546
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula C4H5NO4
Molecular Weight 131.0868
Charge -2
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula Zn
Molecular Weight 65.409
Charge 2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 00:55:25 GMT 2025
Edited
by admin
on Wed Apr 02 00:55:25 GMT 2025
Record UNII
9ZAR5FLK75
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SUPEROXIDE DISMUTASE (CU-ZN) ACTIVE SITE
Preferred Name English
Code System Code Type Description
FDA UNII
9ZAR5FLK75
Created by admin on Wed Apr 02 00:55:25 GMT 2025 , Edited by admin on Wed Apr 02 00:55:25 GMT 2025
PRIMARY
PUBCHEM
133082395
Created by admin on Wed Apr 02 00:55:25 GMT 2025 , Edited by admin on Wed Apr 02 00:55:25 GMT 2025
PRIMARY
DAILYMED
9ZAR5FLK75
Created by admin on Wed Apr 02 00:55:25 GMT 2025 , Edited by admin on Wed Apr 02 00:55:25 GMT 2025
PRIMARY