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Universal:3c2hmp

(2R,3S)-3-isopropylmalate(2-)

Default Component
3c2hmp:-2
  • (2R,3S)-3-isopropylmalate(2-)
  • Charge: -2
  • Formula: C7H10O5
CHEBI:35121
  • (2R,3S)-3-isopropylmalate(2-)
  • Type: Small Molecule
  • InChiKey: RNQHMTFBUSSBJQ-CRCLSJGQSA-L
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 174.1513[0], 174.0[1]
  • SMILES: CC(C)[C@H](C(=O)[O-])[C@@H](O)C(=O)[O-][0,1]
  • Names: 2-D-threo-Hydroxy-3-carboxy-isocaproate[0,1], (2R,3S)-3-Isopropylmalate[0,1], (2R,3S)-2-hydroxy-3-isopropylsuccinate[0], (2R,3S)-2-hydroxy-3-(propan-2-yl)butanedioate[0], (2R,3S)-3-isopropylmalate[0,1], 3-Isopropylmalate[1], 2-D-threo-hydroxy-3-carboxy-isocaproate[1], 3-Carboxy-2-hydroxy-4-methylpentanoate[1], 3-carboxy-2-hydroxy-4-methylpentanoate[1], 3-isopropylmalate[1], beta-isopropylmalate[1]
Data Sources: [0] CHEBI:35121 via ChEBI, [1] cpd02693 via ModelSEED
Linkouts
Data Sources: [0] CHEBI:35121 via ChEBI, [1] cpd02693 via ModelSEED
Alternative Component
3c2hmp:0
  • (2R,3S)-3-isopropylmalic acid
  • Charge: 0
  • Formula: C7H12O5
CHEBI:43468
  • (2R,3S)-3-isopropylmalic acid
  • Type: Small Molecule
  • InChiKey: RNQHMTFBUSSBJQ-CRCLSJGQSA-N
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 176.168[0]
  • SMILES: CC(C)[C@H](C(=O)O)[C@@H](O)C(=O)O[0]
  • Names: (2R,3S)-2-hydroxy-3-(propan-2-yl)butanedioic acid[0], (2R,3S)-2-hydroxy-3-isopropylsuccinic acid[0], 2-D-threo-hydroxy-3-carboxyisocaproic acid[0], (2R,3S)-3-carboxy-2-hydroxy-4-methylpentanoic acid[0], 3-Isopropylmalate[0], 2-D-threo-Hydroxy-3-carboxy-isocaproate[0], 3-Carboxy-2-hydroxy-4-methylpentanoate[0]
Data Sources: [0] CHEBI:43468 via ChEBI
Linkouts
Data Sources: [0] CHEBI:43468 via ChEBI
Metabolite in Models
  BiGG ID Compartment Charge Model Organism
  BiGG ID Compartment Charge Model Organism