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Details

Stereochemistry ACHIRAL
Molecular Formula C30H40N4
Molecular Weight 456.6654
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 2

SHOW SMILES / InChI
Structure of DEQUALINIUM

SMILES

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

InChI

InChIKey=PCSWXVJAIHCTMO-UHFFFAOYSA-P
InChI=1S/C30H38N4/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/p+2

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

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:29:28 UTC 2023
Edited
by admin
on Fri Dec 15 15:29:28 UTC 2023
Record UNII
E7QC7V26B8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DEQUALINIUM
WHO-DD  
Common Name English
1,1'-DECAMETHYLENEBIS(4-AMINOQUINALDINIUM)
Systematic Name English
Dequalinium [WHO-DD]
Common Name English
DEQUALINIUM CATION
Common Name English
Classification Tree Code System Code
WHO-ATC D08AH01
Created by admin on Fri Dec 15 15:29:28 UTC 2023 , Edited by admin on Fri Dec 15 15:29:28 UTC 2023
NCI_THESAURUS C795
Created by admin on Fri Dec 15 15:29:28 UTC 2023 , Edited by admin on Fri Dec 15 15:29:28 UTC 2023
WHO-ATC R02AA02
Created by admin on Fri Dec 15 15:29:28 UTC 2023 , Edited by admin on Fri Dec 15 15:29:28 UTC 2023
WHO-VATC QR02AA02
Created by admin on Fri Dec 15 15:29:28 UTC 2023 , Edited by admin on Fri Dec 15 15:29:28 UTC 2023
WHO-ATC G01AC05
Created by admin on Fri Dec 15 15:29:28 UTC 2023 , Edited by admin on Fri Dec 15 15:29:28 UTC 2023
WHO-VATC QG01AC05
Created by admin on Fri Dec 15 15:29:28 UTC 2023 , Edited by admin on Fri Dec 15 15:29:28 UTC 2023
WHO-VATC QD08AH01
Created by admin on Fri Dec 15 15:29:28 UTC 2023 , Edited by admin on Fri Dec 15 15:29:28 UTC 2023
Code System Code Type Description
EVMPD
SUB01590MIG
Created by admin on Fri Dec 15 15:29:28 UTC 2023 , Edited by admin on Fri Dec 15 15:29:28 UTC 2023
PRIMARY
WIKIPEDIA
DEQUALINIUM
Created by admin on Fri Dec 15 15:29:28 UTC 2023 , Edited by admin on Fri Dec 15 15:29:28 UTC 2023
PRIMARY
EPA CompTox
DTXSID4046941
Created by admin on Fri Dec 15 15:29:28 UTC 2023 , Edited by admin on Fri Dec 15 15:29:28 UTC 2023
PRIMARY
FDA UNII
E7QC7V26B8
Created by admin on Fri Dec 15 15:29:28 UTC 2023 , Edited by admin on Fri Dec 15 15:29:28 UTC 2023
PRIMARY
PUBCHEM
2993
Created by admin on Fri Dec 15 15:29:28 UTC 2023 , Edited by admin on Fri Dec 15 15:29:28 UTC 2023
PRIMARY
DRUG CENTRAL
4376
Created by admin on Fri Dec 15 15:29:28 UTC 2023 , Edited by admin on Fri Dec 15 15:29:28 UTC 2023
PRIMARY
NCI_THESAURUS
C83661
Created by admin on Fri Dec 15 15:29:28 UTC 2023 , Edited by admin on Fri Dec 15 15:29:28 UTC 2023
PRIMARY
RXCUI
3226
Created by admin on Fri Dec 15 15:29:28 UTC 2023 , Edited by admin on Fri Dec 15 15:29:28 UTC 2023
PRIMARY RxNorm
CAS
6707-58-0
Created by admin on Fri Dec 15 15:29:28 UTC 2023 , Edited by admin on Fri Dec 15 15:29:28 UTC 2023
PRIMARY
DRUG BANK
DB04209
Created by admin on Fri Dec 15 15:29:28 UTC 2023 , Edited by admin on Fri Dec 15 15:29:28 UTC 2023
PRIMARY
MESH
D003868
Created by admin on Fri Dec 15 15:29:28 UTC 2023 , Edited by admin on Fri Dec 15 15:29:28 UTC 2023
PRIMARY
SMS_ID
100000087753
Created by admin on Fri Dec 15 15:29:28 UTC 2023 , Edited by admin on Fri Dec 15 15:29:28 UTC 2023
PRIMARY
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