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CHEBI:74653 - 3-thio-L-aspartic acid

ChEBI IDCHEBI:74653
ChEBI Name3-thio-L-aspartic acid
Stars
ASCII Name3-thio-L-aspartic acid
DefinitionA sulfur-containing amino acid that is L-aspartic acid substituted at position 3 by a thio (sulfanyl) group.
Last Modified3 December 2014
SubmitterSteve
DownloadsMolfile
FormulaC4H7NO4S
Net Charge0
Average Mass165.170
Monoisotopic Mass165.00958
SMILESN[C@H](C(=O)O)C(S)C(=O)O
InChIInChI=1S/C4H7NO4S/c5-1(3(6)7)2(10)4(8)9/h1-2,10H,5H2,(H,6,7)(H,8,9)/t1-,2?/m0/s1
InChIKeyMWUQQPGZOPQTIX-PIKHSQJKSA-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).
ChEBI Ontology
Outgoing Relation(s)
3-thio-L-aspartic acid (CHEBI:74653) is a L-aspartic acid derivative (CHEBI:83978)
3-thio-L-aspartic acid (CHEBI:74653) is a amino dicarboxylic acid (CHEBI:36164)
3-thio-L-aspartic acid (CHEBI:74653) is a C4-dicarboxylic acid (CHEBI:66873)
3-thio-L-aspartic acid (CHEBI:74653) is a non-proteinogenic L-α-amino acid (CHEBI:83822)
3-thio-L-aspartic acid (CHEBI:74653) is a sulfur-containing amino acid (CHEBI:26834)
3-thio-L-aspartic acid (CHEBI:74653) is a thiol (CHEBI:29256)
Incoming Relation(s)
3-methylthioaspartic acid (CHEBI:73621) has functional parent 3-thio-L-aspartic acid (CHEBI:74653)
3-thio-L-aspartic acid residue (CHEBI:74652) is substituent group from 3-thio-L-aspartic acid (CHEBI:74653)
IUPAC Name 
3-sulfanyl-L-aspartic acid
Synonym  Source
3-mercapto-L-aspartic acidChEBI