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CHEBI:74104 - 3-[(2-hydroxyethyl)disulfanyl]-L-alanine

ChEBI IDCHEBI:74104
ChEBI Name3-[(2-hydroxyethyl)disulfanyl]-L-alanine
Stars
ASCII Name3-[(2-hydroxyethyl)disulfanyl]-L-alanine
DefinitionAn S-substituted L-cysteine where the S-substituent is specified as (2-hydroxyethyl)sulfane.
Last Modified19 September 2013
Submittermwilliams
DownloadsMolfile
FormulaC5H11NO3S2
Net Charge0
Average Mass197.281
Monoisotopic Mass197.01804
SMILESN[C@@H](CSSCCO)C(=O)O
InChIInChI=1S/C5H11NO3S2/c6-4(5(8)9)3-11-10-2-1-7/h4,7H,1-3,6H2,(H,8,9)/t4-/m0/s1
InChIKeyYPUBRSXDQSFQBA-BYPYZUCNSA-N
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
3-[(2-hydroxyethyl)disulfanyl]-L-alanine (CHEBI:74104) has role metabolite (CHEBI:25212)
3-[(2-hydroxyethyl)disulfanyl]-L-alanine (CHEBI:74104) is a S-substituted L-cysteine (CHEBI:47910)
IUPAC Name 
3-[(2-hydroxyethyl)disulfanyl]-L-alanine
Synonyms  Source
cysteinemercaptoethanol disulfideChEBI
S-(2-Hydroxyethylmercapto)-L-cysteineChemIDplus
Registry NumbersSources
Reaxys:1707531Reaxys
CAS:38254-63-6ChemIDplus