PENOCTONIUM BROMIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C26H50NO2.Br
Molecular Weight	488.585
Optical Activity	NONE
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Br-].CCCCCCCC[N+](CC)(CC)CCOC(=O)C(C1CCCC1)C2CCCC2

InChI

InChIKey=DWUPDLOTOYWYQT-UHFFFAOYSA-M

InChI=1S/C26H50NO2.BrH/c1-4-7-8-9-10-15-20-27(5-2,6-3)21-22-29-26(28)25(23-16-11-12-17-23)24-18-13-14-19-24;/h23-25H,4-22H2,1-3H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula	BrH
Molecular Weight	80.912
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C26H50NO2
Molecular Weight	408.6807
Charge	1
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	NONE

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/4982631

Penoctonium, a chemotherapeutic agent was used in microbial studies. However, information about the further development of this compound is not available.

Approval Year

PubMed

Title	Date	PubMed
[Microbial studies with a new chemotherapeutic agent penoctonium bromide (Ug 767)].	1969-02	4982631

Substance Class	Chemical Created by `admin` on `Mon Mar 31 18:18:02 GMT 2025` Edited by `admin` on `Mon Mar 31 18:18:02 GMT 2025`
Record UNII	HF11NTT6MZ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-78884

Preferred Name

English

PENOCTONIUM BROMIDE

Official Name

English

DIETHYL(2-HYDROXYETHYL)OCTYL AMMONIUM BROMIDE DICYCLOPENTYLACETATE

Systematic Name

English

penoctonium bromide [INN]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C28394