3-CYSTEINYLACETAMINOPHEN

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C11H14N2O4S
Molecular Weight	270.305
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-CYSTEINYLACETAMINOPHEN

Structure Search

SMILES

CC(=O)NC1=CC=C(O)C(SC[C@H](N)C(O)=O)=C1

InChI

InChIKey=LLHICPSCVFRWDT-QMMMGPOBSA-N

InChI=1S/C11H14N2O4S/c1-6(14)13-7-2-3-9(15)10(4-7)18-5-8(12)11(16)17/h2-4,8,15H,5,12H2,1H3,(H,13,14)(H,16,17)/t8-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C11H14N2O4S
Molecular Weight	270.305
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Thu Jul 06 01:56:05 UTC 2023` Edited by `admin` on `Thu Jul 06 01:56:05 UTC 2023`
Record UNII	6Q2X58Y8BP
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

3-CYSTEINYLACETAMINOPHEN

Common Name

English

S-(5-ACETAMIDO-2-HYDROXYPHENYL)CYSTEINE

Systematic Name

English

PARACETAMOL-CYSTEINE

Systematic Name

English

L-CYSTEINE, S-(5-(ACETYLAMINO)-2-HYDROXYPHENYL)-

Systematic Name

English

3-(CYSTEIN-S-YL)PARACETAMOL

Systematic Name

English

Code System Code Type Description

CHEBI

133066

Created by admin on Thu Jul 06 01:56:05 UTC 2023 , Edited by admin on Thu Jul 06 01:56:05 UTC 2023

PRIMARY

MESH

C063450

Created by admin on Thu Jul 06 01:56:05 UTC 2023 , Edited by admin on Thu Jul 06 01:56:05 UTC 2023

PRIMARY

PUBCHEM

171264

Created by admin on Thu Jul 06 01:56:05 UTC 2023 , Edited by admin on Thu Jul 06 01:56:05 UTC 2023

PRIMARY

EPA CompTox

DTXSID70201608

Created by admin on Thu Jul 06 01:56:05 UTC 2023 , Edited by admin on Thu Jul 06 01:56:05 UTC 2023

PRIMARY

FDA UNII

6Q2X58Y8BP

Created by admin on Thu Jul 06 01:56:05 UTC 2023 , Edited by admin on Thu Jul 06 01:56:05 UTC 2023

PRIMARY

CAS

53446-10-9

Created by admin on Thu Jul 06 01:56:05 UTC 2023 , Edited by admin on Thu Jul 06 01:56:05 UTC 2023

PRIMARY

Related Record Type Details


					362O9ITL9D

PARENT -> METABOLITE INACTIVE

Qualification:

URINE

Amount: