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Universal:3c4mop

(2S)-2-isopropyl-3-oxosuccinate(2-)

Default Component
3c4mop:-2
  • (2S)-2-isopropyl-3-oxosuccinate(2-)
  • Charge: -2
  • Formula: C7H8O5
CHEBI:17214
  • (2S)-2-isopropyl-3-oxosuccinate(2-)
  • Type: Small Molecule
  • InChiKey: HIIZAGQWABAMRR-BYPYZUCNSA-L
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 172.13542[0], 172.0[1]
  • SMILES: CC(C)[C@H](C(=O)[O-])C(=O)C(=O)[O-][0,1]
  • Names: (2S)-2-isopropyl-3-oxosuccinate[0,1], (2S)-3-oxo-2-(propan-2-yl)butanedioate[0], 2-isopropyl-3-oxosuccinate[1], (2S)-2-Isopropyl-3-oxosuccinate[1], 2-Oxo-4-methyl-3-carboxypentanoate[1], 3-Carboxy-4-methyl-2-oxopentanoate[1]
Data Sources: [0] CHEBI:17214 via ChEBI, [1] cpd02605 via ModelSEED
Linkouts
Data Sources: [0] CHEBI:17214 via ChEBI, [1] cpd02605 via ModelSEED
Alternative Component
3c4mop:0
  • (2S)-2-isopropyl-3-oxosuccinic acid
  • Charge: 0
  • Formula: C7H10O5
CHEBI:1467
  • (2S)-2-isopropyl-3-oxosuccinic acid
  • Type: Small Molecule
  • InChiKey: HIIZAGQWABAMRR-BYPYZUCNSA-N
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 174.1513[0]
  • SMILES: CC(C)[C@H](C(=O)O)C(=O)C(=O)O[0]
  • Names: (2S)-2-Isopropyl-3-oxosuccinate[0], (2S)-2-(1-methylethyl)-3-oxobutanedioic acid[0], (2S)-3-oxo-2-(propan-2-yl)butanedioic acid[0], 3-Carboxy-4-methyl-2-oxopentanoate[0]
Data Sources: [0] CHEBI:1467 via ChEBI
Linkouts
Data Sources: [0] CHEBI:1467 via ChEBI
Metabolite in Models
  BiGG ID Compartment Charge Model Organism
  BiGG ID Compartment Charge Model Organism