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Universal:ckdo

CMP-3-deoxy-beta-D-manno-octulosonate(2-)

Default Component
ckdo:-2
  • CMP-3-deoxy-beta-D-manno-octulosonate(2-)
  • Charge: -2
  • Formula: C17H24N3O15P
CHEBI:85987
  • CMP-3-deoxy-beta-D-manno-octulosonate(2-)
  • Type: Small Molecule
  • InChiKey: YWWJKULNWGRYAS-UOVSKDHASA-L
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 541.3584[0], 541.0[1]
  • SMILES: [H][C@]1([C@H](O)CO)O[C@](OP(=O)([O-])OC[C@H]2O[C@@H](n3ccc(N)nc3=O)[C@H](O)[C@@H]2O)(C(=O)[O-])C[C@@H](O)[C@H]1O[0], Nc1ccn([C@@H]2O[C@H](COP(=O)([O-])O[C@]3(C(=O)[O-])C[C@@H](O)[C@@H](O)[C@@H]([C@H](O)CO)O3)[C@@H](O)[C@H]2O)c(=O)n1[1]
  • Names: CMP-3-deoxy-beta-D-manno-octulosonate[0,1], CMP-KDO[1], CMP-2-dehydro-3-deoxy-D-octonate[1], CMP-3-deoxy-D-manno-octulosonate[1], CMP-Kdo[1], CMP-alpha-Kdo[1], CMP-beta-Kdo[1], CMP-ketodeoxyoctonate[1]
Data Sources: [0] CHEBI:85987 via ChEBI, [1] cpd02546 via ModelSEED
Linkouts
Data Sources: [0] CHEBI:85987 via ChEBI, [1] cpd02546 via ModelSEED
Alternative Component
ckdo:0
  • CMP-3-deoxy-beta-D-manno-octulosonic acid
  • Charge: 0
  • Formula: C17H26N3O15P
CHEBI:86284
  • CMP-3-deoxy-beta-D-manno-octulosonic acid
  • Type: Small Molecule
  • InChiKey: YWWJKULNWGRYAS-UOVSKDHASA-N
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 543.3732[0]
  • SMILES: [H][C@]1([C@H](O)CO)O[C@](OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(N)nc3=O)[C@H](O)[C@@H]2O)(C(=O)O)C[C@@H](O)[C@H]1O[0]
  • Names: CMP-KDO[0], CMP-beta-KDO[0], CMP-3-deoxy-D-manno-octulosonate[0], cytidine 5'-[(3-deoxy-beta-D-manno-oct-2-ulopyranosonyl) hydrogen phosphate][0]
Data Sources: [0] CHEBI:86284 via ChEBI
Linkouts
Data Sources: [0] CHEBI:86284 via ChEBI
Metabolite in Models
  BiGG ID Compartment Charge Model Organism
  BiGG ID Compartment Charge Model Organism