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Details

Stereochemistry ABSOLUTE
Molecular Formula C8H15NO3S
Molecular Weight 205.275
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-ACETYL-S-PROPYL-L-CYSTEINE

SMILES

CCCSC[C@H](NC(C)=O)C(O)=O

InChI

InChIKey=PSOKBYBSKZWNMI-ZETCQYMHSA-N
InChI=1S/C8H15NO3S/c1-3-4-13-5-7(8(11)12)9-6(2)10/h7H,3-5H2,1-2H3,(H,9,10)(H,11,12)/t7-/m0/s1

HIDE SMILES / InChI

Molecular Formula C8H15NO3S
Molecular Weight 205.275
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Metabolism and disposition of 1-bromopropane in rats and mice following inhalation or intravenous administration.
2006 Aug 15
Globin s-propyl cysteine and urinary N-acetyl-S-propylcysteine as internal biomarkers of 1-bromopropane exposure.
2007 Aug
CYP2E1-catalyzed oxidation contributes to the sperm toxicity of 1-bromopropane in mice.
2007 Mar
Development of an HPLC-MS procedure for the quantification of N-acetyl-S-(n-propyl)-l-cysteine, the major urinary metabolite of 1-bromopropane in human urine.
2009 Mar 15
N-acetyl-S-(n-propyl)-l-cysteine in urine from workers exposed to 1-bromopropane in foam cushion spray adhesives.
2009 Oct
Bromide and N-acetyl-S-(n-propyl)-L-cysteine in urine from workers exposed to 1-bromopropane solvents from vapor degreasing or adhesive manufacturing.
2010 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
A0X44R47N4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-ACETYL-S-PROPYL-L-CYSTEINE
Systematic Name English
L-CYSTEINE, N-ACETYL-S-PROPYL-
Systematic Name English
ALANINE, N-ACETYL-3-(PROPYLTHIO)-
Systematic Name English
PROPYLMERCAPTURIC ACID
Common Name English
ALANINE, N-ACETYL-3-(PROPYLTHIO)-, L-
Systematic Name English
Code System Code Type Description
CAS
14402-54-1
Created by admin on Fri Dec 15 17:45:47 GMT 2023 , Edited by admin on Fri Dec 15 17:45:47 GMT 2023
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EPA CompTox
DTXSID50162602
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
A0X44R47N4
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
PUBCHEM
3084195
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