CHEBI:35121 - (2R,3S)-3-isopropylmalate(2−)

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ChEBI Name (2R,3S)-3-isopropylmalate(2−)
ChEBI ID CHEBI:35121
ChEBI ASCII Name (2R,3S)-3-isopropylmalate(2-)
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:35120, CHEBI:1565
Supplier Information
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Formula C7H10O5
Net Charge -2
Average Mass 174.15130
Monoisotopic Mass 174.053
InChI InChI=1S/C7H12O5/c1-3(2)4(6(9)10)5(8)7(11)12/h3-5,8H,1-2H3,(H,9,10)(H,11,12)/p-2/t4-,5+/m0/s1
InChIKey RNQHMTFBUSSBJQ-CRCLSJGQSA-L
SMILES CC(C)[C@@H]([C@@H](O)C([O-])=O)C([O-])=O
Metabolite of Species Details
Saccharomyces cerevisiae (NCBI:4932) Source: yeast.sf.net See: PubMed
Roles Classification
Biological Role(s): Saccharomyces cerevisiae metabolite
Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (2R,3S)-3-isopropylmalate(2−) (CHEBI:35121) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
(2R,3S)-3-isopropylmalate(2−) (CHEBI:35121) is a 3-isopropylmalate(2−) (CHEBI:15592)
(2R,3S)-3-isopropylmalate(2−) (CHEBI:35121) is conjugate base of (2R,3S)-3-isopropylmalic acid (CHEBI:43468)
Incoming (2R,3S)-3-isopropylmalic acid (CHEBI:43468) is conjugate acid of (2R,3S)-3-isopropylmalate(2−) (CHEBI:35121)
IUPAC Name
(2R,3S)-2-hydroxy-3-(propan-2-yl)butanedioate
Synonyms Sources
(2R,3S)-2-hydroxy-3-isopropylsuccinate ChEBI
(2R,3S)-3-Isopropylmalate KEGG COMPOUND
(2R,3S)-3-isopropylmalate UniProt
2-D-threo-Hydroxy-3-carboxy-isocaproate KEGG COMPOUND
Database Link Database
C04411 KEGG COMPOUND
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Last Modified
29 September 2016