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Universal:oc2coa

trans-oct-2-enoyl-CoA(4-)

Default Component
oc2coa:-4
  • trans-oct-2-enoyl-CoA(4-)
  • Charge: -4
  • Formula: C29H44N7O17P3S
CHEBI:62242
  • trans-oct-2-enoyl-CoA(4-)
  • Type: Small Molecule
  • InChiKey: CPSDNAXXKWVYIY-NTLMCJQISA-J
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 887.683[0], 888.0[1]
  • SMILES: CCCCC/C=C/C(=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: (2E)-octenoyl-CoA(4-)[0], trans-2-octenoyl-coenzyme A(4-)[0], trans-2,3-didehydroacyl-CoA (C8)(4-)[0], trans-oct-2-enoyl-coenzyme A(4-)[0], (2E)-octenoyl-coenzyme A(4-)[0], (2E)-octenoyl-CoA[0,1], (2E)-Octenoyl-CoA[1], (2E)-oct-2-enoyl-CoA[1], 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(2E)-oct-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}[1], trans-2-octenoyl-coenzyme A[1], trans-Oct-2-enoyl-CoA[1], trans-oct-2-enoyl-CoA[1]
Data Sources: [0] CHEBI:62242 via ChEBI, [1] cpd03130 via ModelSEED
Linkouts
Data Sources: [0] CHEBI:62242 via ChEBI, [1] cpd03130 via ModelSEED
Alternative Component
oc2coa:0
  • trans-oct-2-enoyl-CoA
  • Charge: 0
  • Formula: C29H48N7O17P3S
CHEBI:27537
  • trans-oct-2-enoyl-CoA
  • Type: Small Molecule
  • InChiKey: CPSDNAXXKWVYIY-NTLMCJQISA-N
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 891.71568[0]
  • SMILES: CCCCC/C=C/C(=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: trans-Oct-2-enoyl-CoA[0], (2E)-Octenoyl-CoA[0], 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(2E)-oct-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}[0], trans-2-octenoyl-coenzyme A[0], trans-oct-2-enoyl-coenzyme A[0], (2E)-octenoyl-coenzyme A[0], oct-2-trans-enoyl-CoA[0], oct-trans-2-enoyl-CoA[0], 2,3-trans-octenoyl coenzyme A[0], 2E-octenoyl-CoA[0], 2E-octenoyl-coenzyme A[0]
Data Sources: [0] CHEBI:27537 via ChEBI
Linkouts
Data Sources: [0] CHEBI:27537 via ChEBI
Metabolite in Models
  BiGG ID Compartment Charge Model Organism
  BiGG ID Compartment Charge Model Organism