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Universal:arachcoa

icosanoyl-CoA(4-)

Default Component
arachcoa:-4
  • icosanoyl-CoA(4-)
  • Charge: -4
  • Formula: C41H70N7O17P3S
CHEBI:57380
  • icosanoyl-CoA(4-)
  • Type: Small Molecule
  • InChiKey: JYLSVNBJLYCSSW-IBYUJNRCSA-J
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 1058.017[0], 1058.0[1], 1057.0[2]
  • SMILES: CCCCCCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)([O-])[O-][0,1]
  • Names: eicosanoyl-CoA[0,1], 3'-phosphonatoadenosine 5'-(3-{(3R)-3-hydroxy-4-[(3-{[2-(icosanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-2,2-dimethyl-4-oxobutyl} diphosphate)[0], eicosanoyl-CoA(4-)[0], Icosanoyl-CoA[1], Arachidoyl-CoA[1], Eicosanoyl-CoA[1], arachidoyl-CoA[1], icosanoyl-CoA[1], arachidyl coenzyme A[2]
Data Sources: [0] CHEBI:57380 via ChEBI, [1] cpd01393 via ModelSEED, [2] cpd15931 via ModelSEED
Linkouts
Data Sources: [0] CHEBI:57380 via ChEBI, [1] cpd01393 via ModelSEED, [2] cpd15931 via ModelSEED
Alternative Component
arachcoa:0
  • icosanoyl-CoA
  • Charge: 0
  • Formula: C41H74N7O17P3S
CHEBI:15527
  • icosanoyl-CoA
  • Type: Small Molecule
  • InChiKey: JYLSVNBJLYCSSW-IBYUJNRCSA-N
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 1062.049[0]
  • SMILES: CCCCCCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O[0]
  • Names: Eicosanoyl-CoA[0], 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-4-[(3-{[2-(icosanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate)[0], eicosanoyl-CoA[0], arachidoyl-CoA[0], Arachidoyl-CoA[0]
Data Sources: [0] CHEBI:15527 via ChEBI
Linkouts
Data Sources: [0] CHEBI:15527 via ChEBI
Metabolite in Models
  BiGG ID Compartment Charge Model Organism
  BiGG ID Compartment Charge Model Organism