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Universal:3dhsk

3-dehydroshikimate

Default Component
3dhsk:-1
  • 3-dehydroshikimate
  • Charge: -1
  • Formula: C7H7O5
CHEBI:16630
  • 3-dehydroshikimate
  • Type: Small Molecule
  • InChiKey: SLWWJZMPHJJOPH-PHDIDXHHSA-M
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 171.12748[0], 171.0[1]
  • SMILES: O=C([O-])C1=CC(=O)[C@@H](O)[C@H](O)C1[0,1]
  • Names: (4S,5R)-4,5-dihydroxy-3-oxocyclohex-1-ene-1-carboxylate[0], 3-dehydroshikimate[0,1], 3-Dehydroshikimate[1], 3-dehydro-shikimate[1], 3-dehydroshikimic acid[1], 5-dehydroshikimate[1], 5-dehydroshikimic acid[1]
Data Sources: [0] CHEBI:16630 via ChEBI, [1] cpd01716 via ModelSEED
Linkouts
Data Sources: [0] CHEBI:16630 via ChEBI, [1] cpd01716 via ModelSEED
Alternative Component
3dhsk:0
  • 3-dehydroshikimic acid
  • Charge: 0
  • Formula: C7H8O5
CHEBI:30918
  • 3-dehydroshikimic acid
  • Type: Small Molecule
  • InChiKey: SLWWJZMPHJJOPH-PHDIDXHHSA-N
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 172.1354[0]
  • SMILES: O=C(O)C1=CC(=O)[C@@H](O)[C@H](O)C1[0]
  • Names: 5-Dehydroshikimate[0], 3-Dehydroshikimate[0], 3-dehydroshikimic acid[0], (4S,5R)-4,5-dihydroxy-3-oxocyclohex-1-ene-1-carboxylic acid[0], 5-dehydroshikimic acid[0], (-)-3-dehydroshikimic acid[0]
Data Sources: [0] CHEBI:30918 via ChEBI
Linkouts
Data Sources: [0] CHEBI:30918 via ChEBI
Metabolite in Models
  BiGG ID Compartment Charge Model Organism
  BiGG ID Compartment Charge Model Organism