S-(2-(METHYLSULFONYL)ETHYL)GLUTATHIONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C13H23N3O8S2
Molecular Weight	413.467
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of S-(2-(METHYLSULFONYL)ETHYL)GLUTATHIONE

Structure Search

SMILES

CS(=O)(=O)CCSC[C@H](NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O

InChI

InChIKey=IWJDWVXVYILKJO-IUCAKERBSA-N

InChI=1S/C13H23N3O8S2/c1-26(23,24)5-4-25-7-9(12(20)15-6-11(18)19)16-10(17)3-2-8(14)13(21)22/h8-9H,2-7,14H2,1H3,(H,15,20)(H,16,17)(H,18,19)(H,21,22)/t8-,9-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C13H23N3O8S2
Molecular Weight	413.467
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 15:16:47 GMT 2023` Edited by `admin` on `Sat Dec 16 15:16:47 GMT 2023`
Record UNII	ZCT279LS76
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

S-(2-(METHYLSULFONYL)ETHYL)GLUTATHIONE

Common Name

English

2-AMINO-5-((2-(CARBOXYMETHYLAMINO)-1-(2-METHYLSULFONYLETHYLSULFANYLMETHYL)-2-OXO-ETHYL)AMINO)-5-OXO-PENTANOIC ACID

Systematic Name

English

LAROMUSTINE METABOLITE M3

Common Name

English

GLYCINE, L-.GAMMA.-GLUTAMYL-S-(2-(METHYLSULFONYL)ETHYL)-L-CYSTEINYL-

Common Name

English

VNP-4090CE METABOLITE M3

Common Name

English

S-(2-(METHYLSULFONYL)ETHYL)GSH

Common Name

English

Code System Code Type Description

FDA UNII

ZCT279LS76

Created by admin on Sat Dec 16 15:16:47 GMT 2023 , Edited by admin on Sat Dec 16 15:16:47 GMT 2023

PRIMARY

CAS

1290069-62-3

Created by admin on Sat Dec 16 15:16:47 GMT 2023 , Edited by admin on Sat Dec 16 15:16:47 GMT 2023

PRIMARY

PUBCHEM

155804758

Created by admin on Sat Dec 16 15:16:47 GMT 2023 , Edited by admin on Sat Dec 16 15:16:47 GMT 2023

PRIMARY

PUBCHEM

Related Record Type Details


					14J2G0U3NQ

LAROMUSTINE

PARENT -> METABOLITE

Interaction Type:

IN-VITRO

Amount: