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  5. ddcacoa_c:-4
ddcacoa_c:-4 in iAM_Pc455
  • lauroyl-CoA(4-)
  • Charge: -4
  • Formula: C33H54N7O17P3S
  • Compartment: c - cytosol
  • Universal Metabolite: ddcacoa
CHEBI:57375
  • lauroyl-CoA(4-)
  • Type: Small Molecule
  • InChiKey: YMCXGHLSVALICC-GMHMEAMDSA-J
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 945.805[0], 946.0[1]
  • SMILES: CCCCCCCCCCCC(=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: dodecanoyl-CoA[0,1], 3'-phosphonatoadenosine 5'-(3-{(3R)-4-[(3-{[2-(dodecanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} diphosphate)[0], dodecanoyl-coenzyme A(4-)[0], dodecanoyl-CoA(4-)[0], lauroyl-CoA tetraanion[0], lauroyl-coenzyme A(4-)[0], Lauroyl-CoA[1], Dodecanoyl-CoA[1], Dodecanoyl-CoA (n-C12:0CoA)[1], Lauroyl coenzyme A[1], ddcoa[1], dodecanoyl-CoA (n-C12:0CoA)[1], lauroyl coenzyme A[1], lauroyl-CoA[1]
Data Sources: [0] CHEBI:57375 via ChEBI, [1] cpd01260 via ModelSEED
Linkouts
Data Sources: [0] CHEBI:57375 via ChEBI, [1] cpd01260 via ModelSEED
MEMOTE Flags
This metabolite was flagged in the following MEMOTE tests:

A total of 51 (5.62%) metabolites are not consumed by any reaction of the model: thbpt_c, __iAM_Px5__mag160_c, __iAM_Px5__mag180_c, __iAM_Px5__mag181_c, ppcoa_c, ...

Dead-ends are metabolites that can only be produced but not consumed by reactions in the model. They may indicate the presence of network and knowledge gaps. Implementation: Find dead-end metabolites structurally by considering only reaction equations and bounds. FBA is not carried out.

Reactions involving ddcacoa_c in iAM_Pc455
  BiGG ID Name Reference Transport Collection-specific Model
  BiGG ID Name Reference Transport Collection-specific Model