CHEBI:38712 - 2-mercaptosuccinate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-mercaptosuccinate
ChEBI ID CHEBI:38712
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C4H4O4S
Net Charge -2
Average Mass 148.13816
Monoisotopic Mass 147.98413
InChI InChI=1S/C4H6O4S/c5-3(6)1-2(9)4(7)8/h2,9H,1H2,(H,5,6)(H,7,8)/p-2
InChIKey NJRXVEJTAYWCQJ-UHFFFAOYSA-L
SMILES [O-]C(=O)CC(S)C([O-])=O
ChEBI Ontology
Outgoing 2-mercaptosuccinate (CHEBI:38712) has functional parent succinate(2−) (CHEBI:30031)
2-mercaptosuccinate (CHEBI:38712) is a C4-dicarboxylate (CHEBI:61336)
2-mercaptosuccinate (CHEBI:38712) is a thiomalate(2−) (CHEBI:38710)
2-mercaptosuccinate (CHEBI:38712) is tautomer of 3-carboxy-2-sulfidopropanoate (CHEBI:38714)
Incoming 3-carboxy-2-sulfidopropanoate (CHEBI:38714) is tautomer of 2-mercaptosuccinate (CHEBI:38712)
IUPAC Name
2-sulfanylbutanedioate
Synonym Source
2-mercaptobutanedioate ChEBI
Registry Numbers Types Sources
327565 Gmelin Registry Number Gmelin
4986676 Beilstein Registry Number Beilstein
Last Modified
16 February 2011