TEMATROPIUM METHYLSULFATE

Details

Stereochemistry	RACEMIC
Molecular Formula	C20H28NO4.CH3O4S
Molecular Weight	457.538
Optical Activity	( + / - )
Defined Stereocenters	3 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COS([O-])(=O)=O.CCOC(=O)C(C(=O)O[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C)C3=CC=CC=C3

InChI

InChIKey=YLMCBOIUJONUGH-PBHNUWRFSA-M

InChI=1S/C20H28NO4.CH4O4S/c1-4-24-19(22)18(14-8-6-5-7-9-14)20(23)25-17-12-15-10-11-16(13-17)21(15,2)3;1-5-6(2,3)4/h5-9,15-18H,4,10-13H2,1-3H3;1H3,(H,2,3,4)/q+1;/p-1/t15-,16+,17+,18?;

HIDE SMILES / InChI

Molecular Formula	CH3O4S
Molecular Weight	111.097
Charge	-1
Count

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

Molecular Formula	C20H28NO4
Molecular Weight	346.4406
Charge	1
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	3 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Description
Sources: https://www.genome.jp/dbget-bin/www_bget?dr:D06061

Tematropium, a muscarinic acetylcholine receptor antagonist that was studied as an antiasthmatic agent. Information about the current use of this compound is not available.

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:32:56 GMT 2023` Edited by `admin` on `Fri Dec 15 15:32:56 GMT 2023`
Record UNII	2T52M232D8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TEMATROPIUM METHYLSULFATE

Official Name

English

HGP-6

Code

English

TEMATROPIUM METILSULFATE

Official Name

English

TEMATROPIUM METHYLSULPHATE

Common Name

English

TEMATROPIUM METILSULPHATE

Common Name

English

8-AZONIABICYCLO(3.2.1)OCTANE, 3-(3-ETHOXY-1,3-DIOXO-2-PHENYLPROPOXY)-8,8-DIMETHYL-, ENDO-(±)-, METHYL SULPHATE

Systematic Name

English

CDDD-3602

Code

English

8-AZONIABICYCLO(3.2.1)OCTANE, 3-(3-ETHOXY-1,3-DIOXO-2-PHENYLPROPOXY)-8,8-DIMETHYL-, ENDO-(±)-, METHYL SULFATE

Systematic Name

English

tematropium metilsulfate [INN]

Common Name

English

CDDD 3602

Code

English

TEMATROPIUM METHYLSULFATE [USAN]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C66880