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CHEBI:53335 - (S)-3-hydroxy-3-methyl-2-oxopentanoic acid

Default Structure
ChEBI IDCHEBI:53335
ChEBI Name(S)-3-hydroxy-3-methyl-2-oxopentanoic acid
Stars
ASCII Name(S)-3-hydroxy-3-methyl-2-oxopentanoic acid
DefinitionThe S enantiomer of 3-hydroxy-3-methyl-2-oxopentanoic acid.
Last Modified13 October 2009
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC6H10O4
Net Charge0
Average Mass146.142
Monoisotopic Mass146.05791
SMILESCC[C@](C)(O)C(=O)C(=O)O
InChIInChI=1S/C6H10O4/c1-3-6(2,10)4(7)5(8)9/h10H,3H2,1-2H3,(H,8,9)/t6-/m0/s1
InChIKeyYJVOWRAWFXRESP-LURJTMIESA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(S)-3-hydroxy-3-methyl-2-oxopentanoic acid (CHEBI:53335) is a 3-hydroxy-3-methyl-2-oxopentanoic acid (CHEBI:28710)
(S)-3-hydroxy-3-methyl-2-oxopentanoic acid (CHEBI:53335) is conjugate acid of (S)-3-hydroxy-3-methyl-2-oxopentanoate (CHEBI:27765)
(S)-3-hydroxy-3-methyl-2-oxopentanoic acid (CHEBI:53335) is enantiomer of (R)-3-hydroxy-3-methyl-2-oxopentanoic acid (CHEBI:34008)
Incoming Relation(s)
(S)-3-hydroxy-3-methyl-2-oxopentanoate (CHEBI:27765) is conjugate base of (S)-3-hydroxy-3-methyl-2-oxopentanoic acid (CHEBI:53335)
(R)-3-hydroxy-3-methyl-2-oxopentanoic acid (CHEBI:34008) is enantiomer of (S)-3-hydroxy-3-methyl-2-oxopentanoic acid (CHEBI:53335)
IUPAC Name 
(3S)-3-hydroxy-3-methyl-2-oxopentanoic acid
Synonym  Source
(S)-3-hydroxy-3-methyl-2-oxovaleric acidChEBI