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Details

Stereochemistry ABSOLUTE
Molecular Formula C7H13NO4S
Molecular Weight 207.247
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-ACETYL-S-(2-HYDROXYETHYL)-L-CYSTEINE

SMILES

CC(=O)N[C@@H](CSCCO)C(O)=O

InChI

InChIKey=NAYOYSKSFGMFOB-LURJTMIESA-N
InChI=1S/C7H13NO4S/c1-5(10)8-6(7(11)12)4-13-3-2-9/h6,9H,2-4H2,1H3,(H,8,10)(H,11,12)/t6-/m0/s1

HIDE SMILES / InChI

Molecular Formula C7H13NO4S
Molecular Weight 207.247
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Simultaneous determination of mercapturic acids derived from ethylene oxide (HEMA), propylene oxide (2-HPMA), acrolein (3-HPMA), acrylamide (AAMA) and N,N-dimethylformamide (AMCC) in human urine using liquid chromatography/tandem mass spectrometry.
2008 Sep
Simultaneous determination of six mercapturic acid metabolites of volatile organic compounds in human urine.
2009 Jun
Substance Class Chemical
Created
by admin
on Fri Dec 15 17:45:47 GMT 2023
Edited
by admin
on Fri Dec 15 17:45:47 GMT 2023
Record UNII
5125C7A0EK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-ACETYL-S-(2-HYDROXYETHYL)-L-CYSTEINE
Systematic Name English
ALANINE, N-ACETYL-3-((2-HYDROXYETHYL)THIO)-, L-
Systematic Name English
N-ACETYL-S-2-HYDROXYETHYL-L-CYSTEINE
Systematic Name English
S-(2-HYDROXYETHYL)-N-ACETYLCYSTEINE
Systematic Name English
N-ACETYL-S-(2-HYDROXYETHYL)CYSTEINE
Systematic Name English
S-(.BETA.-HYDROXYETHYL)MERCAPTURIC ACID
Common Name English
L-CYSTEINE, N-ACETYL-S-(2-HYDROXYETHYL)-
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C73539
Created by admin on Fri Dec 15 17:45:47 GMT 2023 , Edited by admin on Fri Dec 15 17:45:47 GMT 2023
Code System Code Type Description
PUBCHEM
108009
Created by admin on Fri Dec 15 17:45:47 GMT 2023 , Edited by admin on Fri Dec 15 17:45:47 GMT 2023
PRIMARY
FDA UNII
5125C7A0EK
Created by admin on Fri Dec 15 17:45:47 GMT 2023 , Edited by admin on Fri Dec 15 17:45:47 GMT 2023
PRIMARY
CAS
15060-26-1
Created by admin on Fri Dec 15 17:45:47 GMT 2023 , Edited by admin on Fri Dec 15 17:45:47 GMT 2023
PRIMARY
NCI_THESAURUS
C107146
Created by admin on Fri Dec 15 17:45:47 GMT 2023 , Edited by admin on Fri Dec 15 17:45:47 GMT 2023
PRIMARY NCIT
EPA CompTox
DTXSID00914077
Created by admin on Fri Dec 15 17:45:47 GMT 2023 , Edited by admin on Fri Dec 15 17:45:47 GMT 2023
PRIMARY