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Universal:pac

phenylacetate

Default Component
pac:-1
  • phenylacetate
  • Charge: -1
  • Formula: C8H7O2
CHEBI:18401
  • phenylacetate
  • Type: Small Molecule
  • InChiKey: WLJVXDMOQOGPHL-UHFFFAOYSA-M
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 135.13998[0], 136.0[1]
  • SMILES: O=C([O-])Cc1ccccc1[0,1]
  • Names: phenylacetate[0,1], 2-phenylethanoate[0], 2-phenylacetate[0,1], phenylacetic acid anion[0], phenylacetate anion[0], phenylacetate(1-)[0], Phenylacetic acid[1], Benzeneacetic acid[1], Benzylformic acid[1], Phenylacetate[1], Phenylacetic_acid[1], benzeneacetic acid[1], phenylacetic acid[1]
Data Sources: [0] CHEBI:18401 via ChEBI, [1] cpd19069 via ModelSEED
Linkouts
Data Sources: [0] CHEBI:18401 via ChEBI, [1] cpd19069 via ModelSEED
Alternative Component
pac:0
  • phenylacetic acid
  • Charge: 0
  • Formula: C8H8O2
CHEBI:30745
  • phenylacetic acid
  • Type: Small Molecule
  • InChiKey: WLJVXDMOQOGPHL-UHFFFAOYSA-N
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 136.14792[0], 136.0[1]
  • SMILES: O=C(O)Cc1ccccc1[0], CC(=O)Oc1ccccc1[1]
  • Names: Phenylacetic acid[0,1], Benzylformic acid[0], benzeneacetic acid[0], alpha-toluic acid[0], phenylacetic acid[0], 2-PHENYLACETIC ACID[0], 2-Phenylethanoic acid[0], PA[0], omega-phenylacetic acid[0], Omega-Phenylacetic acid[0], Benzeneacetic acid[0], PACT[1], Acetic acid,phenyl ester[1], Acetylphenol[1], Benzeneacetiic acid[1], C15583[1], Phenyl acetate[1], Phenylaceticacid[1]
Data Sources: [0] CHEBI:30745 via ChEBI, [1] cpd00430 via ModelSEED
Linkouts
Data Sources: [0] CHEBI:30745 via ChEBI, [1] cpd00430 via ModelSEED
Metabolite in Models
  BiGG ID Compartment Charge Model Organism
  BiGG ID Compartment Charge Model Organism