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Universal:3ophb

4-hydroxy-3-octaprenylbenzoate

Default Component
3ophb:-1
  • 4-hydroxy-3-octaprenylbenzoate
  • Charge: -1
  • Formula: C47H69O3
CHEBI:1617
  • 4-hydroxy-3-octaprenylbenzoate
  • Type: Small Molecule
  • InChiKey: UTIBHEBNILDQKX-LQOKPSQISA-M
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 682.04896[0], 681.0[1]
  • SMILES: CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/Cc1cc(C(=O)[O-])ccc1O[0,1]
  • Names: 3-Octaprenyl-4-hydroxybenzoate[0,1], 4-hydroxy-3-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaen-1-yl]benzoate[0], 4-hydroxy-3-(all-trans-octaprenyl)benzoate[0], 4-Hydroxy-3-octaprenylbenzoate[0,1], 3-octaprenyl-4-hydroxybenzoate[1]
Data Sources: [0] CHEBI:1617 via ChEBI, [1] cpd03443 via ModelSEED
Linkouts
Data Sources: [0] CHEBI:1617 via ChEBI, [1] cpd03443 via ModelSEED
Alternative Component
3ophb:0
  • 4-hydroxy-3-octaprenylbenzoic acid
  • Charge: 0
  • Formula: C47H70O3
CHEBI:50116
  • 4-hydroxy-3-octaprenylbenzoic acid
  • Type: Small Molecule
  • InChiKey: UTIBHEBNILDQKX-LQOKPSQISA-N
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 683.0569[0]
  • SMILES: CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/Cc1cc(C(=O)O)ccc1O[0]
  • Names: 4-hydroxy-3-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaen-1-yl]benzoic acid[0]
Data Sources: [0] CHEBI:50116 via ChEBI
Linkouts
Data Sources: [0] CHEBI:50116 via ChEBI
Metabolite in Models
  BiGG ID Compartment Charge Model Organism
  BiGG ID Compartment Charge Model Organism