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Universal:2mp2coa

methacrylyl-CoA(4-)

Default Component
2mp2coa:-4
  • methacrylyl-CoA(4-)
  • Charge: -4
  • Formula: C25H36N7O17P3S
CHEBI:62500
  • methacrylyl-CoA(4-)
  • Type: Small Molecule
  • InChiKey: NPALUEYCDZWBOV-NDZSKPAWSA-J
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 831.576[0], 832.0[1]
  • SMILES: C=C(C)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: 2-methylprop-2-enoyl-CoA(4-)[0], 3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methylprop-2-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] diphosphate}[0], 2-methylpropenoyl-CoA[0], Methacrylyl-CoA[1], 2-Methylprop-2-enoyl-CoA[1], 2-methylprop-2-enoyl-CoA[1], M_Methylacrylyl_CoA[1], Methylacrylyl-CoA[1], methacrylyl-CoA[1], methacrylyl-coenzyme A[1], methylacrylyl-CoA[1]
Data Sources: [0] CHEBI:62500 via ChEBI, [1] cpd02187 via ModelSEED
Linkouts
Data Sources: [0] CHEBI:62500 via ChEBI, [1] cpd02187 via ModelSEED
Alternative Component
2mp2coa:0
  • methacrylyl-CoA
  • Charge: 0
  • Formula: C25H40N7O17P3S
CHEBI:27754
  • methacrylyl-CoA
  • Type: Small Molecule
  • InChiKey: NPALUEYCDZWBOV-NDZSKPAWSA-N
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 835.60936[0]
  • SMILES: C=C(C)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: 2-Methylprop-2-enoyl-CoA[0], Methacrylyl-CoA[0], Methylacrylyl-CoA[0], 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methylprop-2-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate}[0], Methacrylyl-coenzyme A[0], S-methacryloyl-coenzyme-A[0], S-methacryloyl-CoA[0]
Data Sources: [0] CHEBI:27754 via ChEBI
Linkouts
Data Sources: [0] CHEBI:27754 via ChEBI
Metabolite in Models
  BiGG ID Compartment Charge Model Organism
  BiGG ID Compartment Charge Model Organism