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octcoa_c:0 in iCN900
  • octanoyl-CoA
  • Charge: 0
  • Formula: C29H50N7O17P3S
  • Compartment: c - cytosol
  • Universal Metabolite: octcoa
CHEBI:15533
  • octanoyl-CoA
  • Type: Small Molecule
  • InChiKey: KQMZYOXOBSXMII-CECATXLMSA-N
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 893.73[0]
  • SMILES: CCCCCCCC(=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: Octanoyl-CoA[0], 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-[(3-{[2-(octanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-4-oxobutyl} dihydrogen diphosphate)[0], Octanoyl-coenzyme A[0], Octanoyl-coa[0], Coenzyme A, S-octanoate[0], 8:0-CoA[0], capryloyl-CoA[0], octylyl-CoA[0], capryloyl-coenzyme A[0], octylyl-coenzyme A[0], C8:0-CoA[0], octanoylcoenzyme A[0], n-octanoyl-CoA[0]
Data Sources: [0] CHEBI:15533 via ChEBI
Linkouts
Data Sources: [0] CHEBI:15533 via ChEBI
MEMOTE Flags
This metabolite was flagged in the following MEMOTE tests:

This model contains 735 unconserved metabolites: ahcys_c, xmp_c, gam6p_c, agm_c, alaala_c, ...

The list of unconserved metabolites is computed using the algorithm described in section 3.2 of "Detection of Stoichiometric Inconsistencies in Biomolecular Models." Bioinformatics 24, no. 19 (2008): 2245. doi: 10.1093/bioinformatics/btn425.

Reactions involving octcoa_c in iCN900
  BiGG ID Name Reference Transport Collection-specific Model
  BiGG ID Name Reference Transport Collection-specific Model