CHEBI:28839 - 3-disulfanyl-L-alanine

ChEBI IDCHEBI:28839
ChEBI Name3-disulfanyl-L-alanine
Stars
ASCII Name3-disulfanyl-L-alanine
DefinitionAn S-substituted L-cysteine where the S-substituent is specified as sulfanyl.
Secondary ChEBI IDsCHEBI:9551, CHEBI:21269, CHEBI:41628, CHEBI:41711, CHEBI:41718, CHEBI:41743
Last Modified31 January 2024
DownloadsMolfile
FormulaC3H7NO2S2
Net Charge0
Average Mass153.228
Monoisotopic Mass152.99182
SMILESN[C@@H](CSS)C(=O)O
InChIInChI=1S/C3H7NO2S2/c4-2(1-8-7)3(5)6/h2,7H,1,4H2,(H,5,6)/t2-/m0/s1
InChIKeyXBKONSCREBSMCS-REOHCLBHSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
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 Roles:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
3-disulfanyl-L-alanine (CHEBI:28839) has role human metabolite (CHEBI:77746)
3-disulfanyl-L-alanine (CHEBI:28839) has role mouse metabolite (CHEBI:75771)
3-disulfanyl-L-alanine (CHEBI:28839) is a S-substituted L-cysteine (CHEBI:47910)
3-disulfanyl-L-alanine (CHEBI:28839) is tautomer of 3-disulfanyl-L-alanine zwitterion (CHEBI:58591)
Incoming Relation(s)
3-disulfanyl-L-alanine residue (CHEBI:61963) is substituent group from 3-disulfanyl-L-alanine (CHEBI:28839)
3-disulfanyl-L-alanine zwitterion (CHEBI:58591) is tautomer of 3-disulfanyl-L-alanine (CHEBI:28839)
IUPAC Name 
3-disulfanyl-L-alanine
Synonyms  Source
ThiocysteineKEGG COMPOUND
cysteine persulfideChEBI
2-amino-3-disulfanylpropanoic acidRESID
2-amino-3-hydrodisulfidopropanoic acidRESID
2-amino-3-hydropersulfidopropanoic acidRESID
2-amino-3-persulfhydrylpropanoic acidRESID
Manual XrefsDatabases
C01962KEGG COMPOUND
AA0269RESID
DB02761DrugBank
CSSPDBeChem
Registry NumbersSources
Reaxys:6381723Reaxys
CAS:5652-32-4KEGG COMPOUND
CAS:5652-32-4ChemIDplus
Citations