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Universal:3htdcoa

(S)-3-hydroxytetradecanoyl-CoA(4-)

Default Component
3htdcoa:-4
  • (S)-3-hydroxytetradecanoyl-CoA(4-)
  • Charge: -4
  • Formula: C35H58N7O18P3S
CHEBI:62614
  • (S)-3-hydroxytetradecanoyl-CoA(4-)
  • Type: Small Molecule
  • InChiKey: OXBHKMHNDGRDCZ-STLSENOWSA-J
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 989.857[0], 990.0[1], 993.0[2]
  • SMILES: CCCCCCCCCCC[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-][0,1,2]
  • Names: 3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxytetradecanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] diphosphate}[0], (3S)-hydroxytetradecanoyl-CoA[0], (S)-3-Hydroxytetradecanoyl-CoA[1], 3-hydroxytetradecanoyl-CoA[1], (S)-3-hydroxytetradecanoyl-CoA[2]
Data Sources: [0] CHEBI:62614 via ChEBI, [1] cpd03115 via ModelSEED, [2] cpd26436 via ModelSEED
Linkouts
Data Sources: [0] CHEBI:62614 via ChEBI, [1] cpd03115 via ModelSEED, [2] cpd26436 via ModelSEED
Alternative Component
3htdcoa:0
  • (S)-3-hydroxytetradecanoyl-CoA
  • Charge: 0
  • Formula: C35H62N7O18P3S
CHEBI:27466
  • (S)-3-hydroxytetradecanoyl-CoA
  • Type: Small Molecule
  • InChiKey: OXBHKMHNDGRDCZ-STLSENOWSA-N
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 993.89044[0]
  • SMILES: CCCCCCCCCCC[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]
  • Names: (S)-3-Hydroxytetradecanoyl-CoA[0], 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxytetradecanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}[0]
Data Sources: [0] CHEBI:27466 via ChEBI
Linkouts
Data Sources: [0] CHEBI:27466 via ChEBI
Metabolite in Models
  BiGG ID Compartment Charge Model Organism
  BiGG ID Compartment Charge Model Organism