Universal:mmcoa__S

(S)-methylmalonyl-CoA(5-)

Default Component
mmcoa__S:-5
  • (S)-methylmalonyl-CoA(5-)
  • Charge: -5
  • Formula: C25H35N7O19P3S
CHEBI:57327
  • (S)-methylmalonyl-CoA(5-)
  • Type: Small Molecule
  • InChiKey: MZFOKIKEPGUZEN-IBNUZSNCSA-I
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 862.567[0], 863.0[1]
  • SMILES: C[C@@H](C(=O)[O-])C(=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: (S)-methylmalonyl-CoA[0,1], D-methylmalonyl-CoA[1], (2S)-Methylmalonyl-CoA[1], (2S)-methyl-malonyl-CoA[1], (S)-2-Methyl-3-oxopropionyl-CoA[1], (S)-3-Oxo-2-methylpropanoyl-CoA[1], (S)-Methylmalonyl-CoA[1], (S)-Methylmalonyl-coenzyme A[1], CH3-malonyl-CoA[1], D-Methylmalonyl-CoA[1], methyl-malonyl-coenzyme A[1]
Linkouts
Alternative Component
mmcoa__S:0
  • (S)-methylmalonyl-CoA
  • Charge: 0
  • Formula: C25H40N7O19P3S
CHEBI:15466
  • (S)-methylmalonyl-CoA
  • Type: Small Molecule
  • InChiKey: MZFOKIKEPGUZEN-IBNUZSNCSA-N
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 867.60816[0]
  • SMILES: C[C@@H](C(=O)O)C(=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)-2-Methyl-3-oxopropanoyl-CoA[0], (S)-2-Methyl-3-oxopropionyl-CoA[0], (S)-Methylmalonyl-CoA[0], (S)-Methylmalonyl-coenzyme A[0], (S)-3-oxo-2-methylpropanoyl-CoA[0], 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(2S)-2-methyl-3-oxopropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}[0]
Linkouts
Metabolite in Models
  BiGG ID Compartment Charge Model Organism
  BiGG ID Compartment Charge Model Organism