HEXEDINE

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	MIXED
Molecular Formula	C22H45N3
Molecular Weight	351.6128
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of HEXEDINE

Structure Search

SMILES

CCCCC(CC)CN1CN2CN(CC(CC)CCCC)CC2(C)C1

InChI

InChIKey=MSJBLPVXRJMJSY-UHFFFAOYSA-N

InChI=1S/C22H45N3/c1-6-10-12-20(8-3)14-23-16-22(5)17-24(19-25(22)18-23)15-21(9-4)13-11-7-2/h20-21H,6-19H2,1-5H3

HIDE SMILES / InChI

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/7696545

Hexedine has been used as an antimicrobial agent and drug constituent. Information about the current use of this drug is not available.

Approval Year

PubMed

PubMed

Title	Date	PubMed
The nitrosation of hexetidine and hexedine: characterization of the major nitrosamine from common antimicrobial agents.	1994-11-01	7696545

Name

Type

Language

HEXEDINE

Official Name

English

STERISOL

Preferred Name

English

hexedine [INN]

Common Name

English

HEXETIDINE IMPURITY C [EP IMPURITY]

Common Name

English

W-4701

Code

English

NSC-356715

Code

English

HEXEDINE [MI]

Common Name

English

W 4701

Code

English

HEXEDINE [USAN]

Common Name

English

1H-IMIDAZO(1,5-C)IMIDAZOLE, 2,6-BIS(2-ETHYLHEXYL)HEXAHYDRO-7A-METHYL-

Common Name

English

2,6-Bis(2-ethylhexyl)-hexahydro-7a-methyl-1H-imidazo[1,5-c]imidazole

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C28394

Created by admin on Mon Mar 31 17:53:51 GMT 2025 , Edited by admin on Mon Mar 31 17:53:51 GMT 2025

Code System Code Type Description

PUBCHEM

22291

Created by admin on Mon Mar 31 17:53:51 GMT 2025 , Edited by admin on Mon Mar 31 17:53:51 GMT 2025

PRIMARY

EVMPD

SUB08035MIG

Created by admin on Mon Mar 31 17:53:51 GMT 2025 , Edited by admin on Mon Mar 31 17:53:51 GMT 2025

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CAS

5980-31-4

Created by admin on Mon Mar 31 17:53:51 GMT 2025 , Edited by admin on Mon Mar 31 17:53:51 GMT 2025

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NSC

356715

Created by admin on Mon Mar 31 17:53:51 GMT 2025 , Edited by admin on Mon Mar 31 17:53:51 GMT 2025

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EPA CompTox

DTXSID70863669

Created by admin on Mon Mar 31 17:53:51 GMT 2025 , Edited by admin on Mon Mar 31 17:53:51 GMT 2025

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SMS_ID

100000083978

Created by admin on Mon Mar 31 17:53:51 GMT 2025 , Edited by admin on Mon Mar 31 17:53:51 GMT 2025

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ChEMBL

CHEMBL2104884

Created by admin on Mon Mar 31 17:53:51 GMT 2025 , Edited by admin on Mon Mar 31 17:53:51 GMT 2025

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MERCK INDEX

m760

Created by admin on Mon Mar 31 17:53:51 GMT 2025 , Edited by admin on Mon Mar 31 17:53:51 GMT 2025

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Merck Index

FDA UNII

LRE2528Y9E

Created by admin on Mon Mar 31 17:53:51 GMT 2025 , Edited by admin on Mon Mar 31 17:53:51 GMT 2025

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NCI_THESAURUS

C83754

Created by admin on Mon Mar 31 17:53:51 GMT 2025 , Edited by admin on Mon Mar 31 17:53:51 GMT 2025

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INN

1947

Created by admin on Mon Mar 31 17:53:51 GMT 2025 , Edited by admin on Mon Mar 31 17:53:51 GMT 2025

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ACTIVE MOIETY


					LRE2528Y9E

HEXEDINE