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Details

Stereochemistry ACHIRAL
Molecular Formula C30H40N4.2Cl
Molecular Weight 527.571
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DEQUALINIUM CHLORIDE

SMILES

[Cl-].[Cl-].CC1=[N+](CCCCCCCCCC[N+]2=C(C)C=C(N)C3=C2C=CC=C3)C4=C(C=CC=C4)C(N)=C1

InChI

InChIKey=LTNZEXKYNRNOGT-UHFFFAOYSA-N
InChI=1S/C30H38N4.2ClH/c1-23-21-27(31)25-15-9-11-17-29(25)33(23)19-13-7-5-3-4-6-8-14-20-34-24(2)22-28(32)26-16-10-12-18-30(26)34;;/h9-12,15-18,21-22,31-32H,3-8,13-14,19-20H2,1-2H3;2*1H

HIDE SMILES / InChI
Molecular Formula C30H38N4
Molecular Weight 454.6495
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE
Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
86413
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:00:55 UTC 2023
Edited
by admin
on Fri Dec 15 15:00:55 UTC 2023
Record UNII
XYS8INN1I6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DEQUALINIUM CHLORIDE
EP   INCI   INN   JAN   MART.   MI   WHO-DD  
INCI   INN  
Official Name English
FLUOMIZIN
Brand Name English
DEQUALINIUM CHLORIDE [MI]
Common Name English
DEQUALINIUM CHLORIDE [MART.]
Common Name English
DEKAMIN
Common Name English
DEQUALINIUM CHLORIDE [INCI]
Common Name English
GNF-PF-5483
Code English
1,1'-(1,10-DECANEDIYL)BIS-(4-AMINO-2-METHYLQUINOLINIUM CHLORIDE)
Common Name English
DEQUALINIUM CHLORIDE [EP MONOGRAPH]
Common Name English
NSC-166454
Code English
Dequalinium chloride [WHO-DD]
Common Name English
BAQD-10
Code English
BAQD 10
Code English
DECAMINE
Common Name English
DEQUALINIUM DICHLORIDE
Common Name English
1,10-DECAMETHYLENE-BIS(4-AMINOQUINALDINIUM CHLORIDE)
Common Name English
dequalinium chloride [INN]
Common Name English
1,1'-DECAMETHYLENEBIS(4-AMINOQUINALDINIUM CHLORIDE)
Common Name English
DEQUALINIUM CHLORIDE [JAN]
Common Name English
NORDMAN
Brand Name English
Classification Tree Code System Code
NCI_THESAURUS C795
Created by admin on Fri Dec 15 15:00:56 UTC 2023 , Edited by admin on Fri Dec 15 15:00:56 UTC 2023
Code System Code Type Description
NSC
166454
Created by admin on Fri Dec 15 15:00:56 UTC 2023 , Edited by admin on Fri Dec 15 15:00:56 UTC 2023
PRIMARY
INN
746
Created by admin on Fri Dec 15 15:00:56 UTC 2023 , Edited by admin on Fri Dec 15 15:00:56 UTC 2023
PRIMARY
PUBCHEM
10649
Created by admin on Fri Dec 15 15:00:56 UTC 2023 , Edited by admin on Fri Dec 15 15:00:56 UTC 2023
PRIMARY
ChEMBL
CHEMBL333826
Created by admin on Fri Dec 15 15:00:56 UTC 2023 , Edited by admin on Fri Dec 15 15:00:56 UTC 2023
PRIMARY
CHEBI
31466
Created by admin on Fri Dec 15 15:00:56 UTC 2023 , Edited by admin on Fri Dec 15 15:00:56 UTC 2023
PRIMARY
CAS
522-51-0
Created by admin on Fri Dec 15 15:00:56 UTC 2023 , Edited by admin on Fri Dec 15 15:00:56 UTC 2023
PRIMARY
SMS_ID
100000091069
Created by admin on Fri Dec 15 15:00:56 UTC 2023 , Edited by admin on Fri Dec 15 15:00:56 UTC 2023
PRIMARY
EVMPD
SUB06985MIG
Created by admin on Fri Dec 15 15:00:56 UTC 2023 , Edited by admin on Fri Dec 15 15:00:56 UTC 2023
PRIMARY
DRUG BANK
DBSALT001926
Created by admin on Fri Dec 15 15:00:56 UTC 2023 , Edited by admin on Fri Dec 15 15:00:56 UTC 2023
PRIMARY
MERCK INDEX
m4184
Created by admin on Fri Dec 15 15:00:56 UTC 2023 , Edited by admin on Fri Dec 15 15:00:56 UTC 2023
PRIMARY Merck Index
EPA CompTox
DTXSID3045144
Created by admin on Fri Dec 15 15:00:56 UTC 2023 , Edited by admin on Fri Dec 15 15:00:56 UTC 2023
PRIMARY
FDA UNII
XYS8INN1I6
Created by admin on Fri Dec 15 15:00:56 UTC 2023 , Edited by admin on Fri Dec 15 15:00:56 UTC 2023
PRIMARY
RXCUI
3120
Created by admin on Fri Dec 15 15:00:56 UTC 2023 , Edited by admin on Fri Dec 15 15:00:56 UTC 2023
PRIMARY RxNorm
NCI_THESAURUS
C77046
Created by admin on Fri Dec 15 15:00:56 UTC 2023 , Edited by admin on Fri Dec 15 15:00:56 UTC 2023
PRIMARY
ECHA (EC/EINECS)
208-330-9
Created by admin on Fri Dec 15 15:00:56 UTC 2023 , Edited by admin on Fri Dec 15 15:00:56 UTC 2023
PRIMARY
Related Record Type Details
Structure of DEQUALINIUM
PARENT -> SALT/SOLVATE
Related Record Type Details
Structure of DEQUALINIUM
ACTIVE MOIETY
NIH
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