CYCOTIAMINE HYDROCHLORIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H16N4O3S.ClH
Molecular Weight	344.817
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.CC(N(CC1=C(N)N=C(C)N=C1)C=O)=C2CCOC(=O)S2

InChI

InChIKey=TWKGUAZLHNQNQW-YGCVIUNWSA-N

InChI=1S/C13H16N4O3S.ClH/c1-8(11-3-4-20-13(19)21-11)17(7-18)6-10-5-15-9(2)16-12(10)14;/h5,7H,3-4,6H2,1-2H3,(H2,14,15,16);1H/b11-8+;

HIDE SMILES / InChI

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

Molecular Formula	C13H16N4O3S
Molecular Weight	308.356
Charge	0
Count

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

Description
Sources: http://repository.kulib.kyoto-u.ac.jp/dspace/bitstream/2433/119923/1/14_0767.pdf
Curator's Comment: description was created based on several sources, including, http://www.drugfuture.com/mt/thiamine-nitrate.pdf

Cycotiamine is a derivative of tiamine that was developed in Japan and used for the treatment of neurogenic bladder.

Approval Year

Conditions

Condition	Modality	Targets	Highest Phase	Product
Neurogenic bladder 6 Sources: http://www.ncbi.nlm.nih.gov/pubmed/5751425	Palliative		Approved 8429	COMETAMIN Approved Use Unknown

PubMed

Title	Date	PubMed
[Clinical effects of cycothiamine (Cometamin) on neurogenic bladder: cystometric study].	1968 Oct	5751425

Patents

Sample Use Guides

In Vivo Use Guide

900 to 3,700 mg given by intravenous administration.

Route of Administration: Intravenous

In Vitro Use Guide

Unknown

Substance Class	Chemical Created by `admin` on `Sat Dec 16 05:26:09 GMT 2023` Edited by `admin` on `Sat Dec 16 05:26:09 GMT 2023`
Record UNII	D91A3111VY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CYCOTIAMINE HYDROCHLORIDE

Common Name

English

CYCOTHIAMINE HYDROCHLORIDE

Common Name

English

CYCOTIAMINE HYDROCHLORIDE [JAN]

Common Name

English

CYCOTHIAMIN HYDROCHLORIDE

Common Name

English

Cycotiamine hydrochloride [WHO-DD]

Common Name

English

O,S-CYCLOCARBOTHIAMINE HYDROCHLORIDE

Common Name

English

CYCOTHIAMIN HYDROCHLORIDE [MI]

Common Name

English

FORMAMIDE, N-((4-AMINO-2-METHYL-5-PYRIMIDINYL)METHYL)-N-(1-(2-OXO-1,3-OXATHIAN-4-YLIDENE)ETHYL)-, MONOHYDROCHLORIDE

Common Name

English

FORMAMIDE, N-((4-AMINO-2-METHYL-5-PYRIMIDINYL)METHYL)-N-(1-(2-OXO-1,3-OXATHIAN-4-YLIDENE)ETHYL)-, HYDROCHLORIDE (1:1)

Systematic Name

English

Code System Code Type Description

CAS

19488-19-8