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3hodcoa_c:-4 in iSbBS512_1146
  • (3S)-3-hydroxyoctadecanoyl-CoA(4-)
  • Charge: -4
  • Formula: C39H66N7O18P3S
  • Compartment: c - cytosol
  • Universal Metabolite: 3hodcoa
CHEBI:87561
  • (3S)-3-hydroxyoctadecanoyl-CoA(4-)
  • Type: Small Molecule
  • InChiKey: WZMAIEGYXCOYSH-SFKGBVSGSA-J
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 1045.966[0], 1046.0[1,2], 1049.0[3]
  • SMILES: CCCCCCCCCCCCCCC[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-][0,2], CCCCCCCCCCCCCCCC(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-][1], CCCCCCCCCCCCCCC[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-][3]
  • Names: (3S)-hydroxyoctadecanoyl-CoA[0], (3S)-3-hydroxystearoyl-CoA(4-)[0], (3S)-3-hydroxystearoyl-coenzyme A(4-)[0], (3S)-3-hydroxyoctadecanoyl-coenzyme A(4-)[0], 3-Hydroxystearoyl-CoA[1], 3-Hydroxyoctadecanoyl-CoA[1], beta-Hydroxystearoyl-CoA[1], (S)-3-Hydroxyoctadecanoyl-CoA[2], (S)-3-hydroxy-stearoyl-CoA[2], (3R)-3-hydroxy-stearoyl-CoA[3], (3R)-3-hydroxyoctadecanoyl-CoA[3], (3R)-3-hydroxystearoyl-CoA[3], beta-hydroxystearoyl-CoA[3]
Data Sources: [0] CHEBI:87561 via ChEBI, [1] cpd14936 via ModelSEED, [2] cpd15204 via ModelSEED, [3] cpd22621 via ModelSEED
Linkouts
Data Sources: [0] CHEBI:87561 via ChEBI, [1] cpd14936 via ModelSEED, [2] cpd15204 via ModelSEED, [3] cpd22621 via ModelSEED
Reactions involving 3hodcoa_c in iSbBS512_1146
  BiGG ID Name Reference Transport Collection-specific Model
  BiGG ID Name Reference Transport Collection-specific Model