CHEBI:194520 - 3,5-dihydroxy-3-methylpentanoate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3,5-dihydroxy-3-methylpentanoate
ChEBI ID CHEBI:194520
Definition A hydroxy monocarboxylic acid anion that is the conjugate base of 3,5-dihydroxy-3-methylpentanoic acid resulting from the deprotonation of the carboxy group; Major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C6H11O4
Net Charge -1
Average Mass 147.151
Monoisotopic Mass 147.06628
InChI InChI=1S/C6H12O4/c1-6(10,2-3-7)4-5(8)9/h7,10H,2-4H2,1H3,(H,8,9)/p-1
InChIKey KJTLQQUUPVSXIM-UHFFFAOYSA-M
SMILES CC(O)(CCO)CC([O-])=O
ChEBI Ontology
Outgoing 3,5-dihydroxy-3-methylpentanoate (CHEBI:194520) has functional parent valerate (CHEBI:31011)
3,5-dihydroxy-3-methylpentanoate (CHEBI:194520) is a hydroxy monocarboxylic acid anion (CHEBI:36059)
3,5-dihydroxy-3-methylpentanoate (CHEBI:194520) is conjugate base of 3,5-dihydroxy-3-methylpentanoic acid (CHEBI:194519)
Incoming (R)-mevalonate (CHEBI:36464) is a 3,5-dihydroxy-3-methylpentanoate (CHEBI:194520)
(S)-mevalonate (CHEBI:18790) is a 3,5-dihydroxy-3-methylpentanoate (CHEBI:194520)
3,5-dihydroxy-3-methylpentanoic acid (CHEBI:194519) is conjugate acid of 3,5-dihydroxy-3-methylpentanoate (CHEBI:194520)
IUPAC Name
3,5-dihydroxy-3-methylpentanoate
Synonyms Sources
2,4-dideoxy-3-C-methylpentonate ChEBI
3,5-dihydroxy-3-methylvalerate ChEBI
β,δ-dihydroxy-β-methylvalerate ChEBI
Last Modified
23 March 2023
General Comment
2023-03-23 This is the entry for material with unspecified stereochemistry. There are separate entries for the racemic mixture (mevalonate) and its individual enantiomers (R)- and (S)-mevalonate.