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3hocoa_c:-4 in iAF987
  • (S)-3-hydroxyoctanoyl-CoA(4-)
  • Charge: -4
  • Formula: C29H46N7O18P3S
  • Compartment: c - cytosol
  • Universal Metabolite: 3hocoa
CHEBI:62617
  • (S)-3-hydroxyoctanoyl-CoA(4-)
  • Type: Small Molecule
  • InChiKey: ATVGTMKWKDUCMS-OTOYJEMWSA-J
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 905.698[0], 906.0[1]
  • SMILES: CCCCC[C@H](O)CC(=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], CCCCC[C@H](O)CC(=O)SCCNC(=O)CCNC(=O)C(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-][1]
  • Names: (S)-3-hydroxycapryloyl-CoA(4-)[0], 3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxyoctanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] diphosphate}[0], (3S)-hydroxyoctanoyl-CoA[0], (S)-Hydroxyoctanoyl-CoA[1], (S)-3-Hydroxycapryloyl-CoA[1], (S)-3-Hydroxyoctanoyl-CoA[1], (S)-3-hydroxyoctanoyl-CoA[1]
Data Sources: [0] CHEBI:62617 via ChEBI, [1] cpd03120 via ModelSEED
Linkouts
Data Sources: [0] CHEBI:62617 via ChEBI, [1] cpd03120 via ModelSEED
Reactions involving 3hocoa_c in iAF987
  BiGG ID Name Reference Transport Collection-specific Model
  BiGG ID Name Reference Transport Collection-specific Model