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CHEBI:87522 - (S)-4-hydroxy-2-oxoheptanedioate

ChEBI IDCHEBI:87522
ChEBI Name(S)-4-hydroxy-2-oxoheptanedioate
Stars
ASCII Name(S)-4-hydroxy-2-oxoheptanedioate
DefinitionA 4-hydroxy-2-oxoheptanedioate obtained by deprotonation of both carboxy groups of (S)-4-hydroxy-2-oxoheptanedioic acid; major species at pH 7.3.
Last Modified3 September 2015
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC7H8O6
Net Charge-2
Average Mass188.135
Monoisotopic Mass188.03319
SMILESO=C([O-])CC[C@H](O)CC(=O)C(=O)[O-]
InChIInChI=1S/C7H10O6/c8-4(1-2-6(10)11)3-5(9)7(12)13/h4,8H,1-3H2,(H,10,11)(H,12,13)/p-2/t4-/m0/s1
InChIKeyHNOAJOYERZTSNK-BYPYZUCNSA-L
ChEBI Ontology
Outgoing Relation(s)
(S)-4-hydroxy-2-oxoheptanedioate (CHEBI:87522) is a 4-hydroxy-2-oxoheptanedioate (CHEBI:73036)
(S)-4-hydroxy-2-oxoheptanedioate (CHEBI:87522) is conjugate base of (S)-4-hydroxy-2-oxoheptanedioic acid (CHEBI:87773)
Incoming Relation(s)
(S)-4-hydroxy-2-oxoheptanedioic acid (CHEBI:87773) is conjugate acid of (S)-4-hydroxy-2-oxoheptanedioate (CHEBI:87522)
IUPAC Name 
(4S)-4-hydroxy-2-oxoheptanedioate
UniProt Name  Source
(4S)-4-hydroxy-2-oxoheptanedioateUniProt