S-(2-CHLORO-4-NITROPHENYL)GLUTATHIONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C16H19ClN4O8S
Molecular Weight	462.862
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of S-(2-CHLORO-4-NITROPHENYL)GLUTATHIONE

Structure Search

SMILES

N[C@@H](CCC(=O)N[C@@H](CSC1=C(Cl)C=C(C=C1)[N+]([O-])=O)C(=O)NCC(O)=O)C(O)=O

InChI

InChIKey=OZBMWBFIPDPGSP-QWRGUYRKSA-N

InChI=1S/C16H19ClN4O8S/c17-9-5-8(21(28)29)1-3-12(9)30-7-11(15(25)19-6-14(23)24)20-13(22)4-2-10(18)16(26)27/h1,3,5,10-11H,2,4,6-7,18H2,(H,19,25)(H,20,22)(H,23,24)(H,26,27)/t10-,11-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C16H19ClN4O8S
Molecular Weight	462.862
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 `Fri Dec 15 19:51:34 GMT 2023` Edited by `admin` on `Fri Dec 15 19:51:34 GMT 2023`
Record UNII	C5G5EGM57U
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

S-(2-CHLORO-4-NITROPHENYL)GLUTATHIONE

Systematic Name

English

GLYCINE, L-.GAMMA.-GLUTAMYL-S-(2-CHLORO-4-NITROPHENYL)-L-CYSTEINYL-

Systematic Name

English

GLUTAMINE, N-(1-((CARBOXYMETHYL)CARBAMOYL)-2-((2-CHLORO-4-NITROPHENYL)THIO)ETHYL)-

Systematic Name

English

GLYCINE, N-(S-(2-CHLORO-4-NITROPHENYL)-N-L-.GAMMA.-GLUTAMYL-L-CYSTEINYL)-

Systematic Name

English

Code System Code Type Description

FDA UNII

C5G5EGM57U