ARLIPOIC ACID CHOLINE ESTER TOSYLATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C13H26NO2S2.C7H7O3S
Molecular Weight	463.675
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ARLIPOIC ACID CHOLINE ESTER TOSYLATE

Structure Search

SMILES

CC1=CC=C(C=C1)S([O-])(=O)=O.C[N+](C)(C)CCOC(=O)CCCC[C@@H]2CCSS2

InChI

InChIKey=SHSBRPKTDQEVLB-UTONKHPSSA-M

InChI=1S/C13H26NO2S2.C7H8O3S/c1-14(2,3)9-10-16-13(15)7-5-4-6-12-8-11-17-18-12;1-6-2-4-7(5-3-6)11(8,9)10/h12H,4-11H2,1-3H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1/t12-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C13H26NO2S2
Molecular Weight	292.481
Charge	1
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	C7H7O3S
Molecular Weight	171.194
Charge	-1
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 `Sat Dec 16 19:10:15 UTC 2023` Edited by `admin` on `Sat Dec 16 19:10:15 UTC 2023`
Record UNII	3G2L8N6PQM
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ARLIPOIC ACID CHOLINE ESTER TOSYLATE

Common Name

English

ARLIPOIC ACID CHOLINE ESTER TOSILATE

Common Name

English

2-((5-(3R)-1,2-DITHIOLAN-3-YL-1-OXOPENTYL)OXY)-N,N,N-TRIMETHYLETHANAMINIUM TOSYLATE

Systematic Name

English

ALPHA-R-LIPOIC ACID CHOLINE ESTER TOSILATE

Common Name

English

Code System Code Type Description

SMS_ID

300000019953

Created by admin on Sat Dec 16 19:10:16 UTC 2023 , Edited by admin on Sat Dec 16 19:10:16 UTC 2023

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FDA UNII

3G2L8N6PQM

Created by admin on Sat Dec 16 19:10:16 UTC 2023 , Edited by admin on Sat Dec 16 19:10:16 UTC 2023

PRIMARY

PUBCHEM

163203569

Created by admin on Sat Dec 16 19:10:16 UTC 2023 , Edited by admin on Sat Dec 16 19:10:16 UTC 2023

PRIMARY

CAS

2705844-44-4

Created by admin on Sat Dec 16 19:10:16 UTC 2023 , Edited by admin on Sat Dec 16 19:10:16 UTC 2023

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