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Universal:nadhx__S

(S)-NADHX(2-)

Default Component
nadhx__S:-2
  • (S)-NADHX(2-)
  • Charge: -2
  • Formula: C21H29N7O15P2
CHEBI:64074
  • (S)-NADHX(2-)
  • Type: Small Molecule
  • InChiKey: IDBZKGQRLBFUFQ-VPHRTNKSSA-L
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 681.4404[0], 681.0[1]
  • SMILES: NC(=O)C1=CN([C@@H]2O[C@H](COP(=O)([O-])OP(=O)([O-])OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)[C@@H](O)CC1[0,1]
  • Names: (6S)-NADHX[0], (6S)-6-beta-Hydroxy-1,4,5,6-tetrahydronicotinamide-adenine dinucleotide[1], (6S)-6-Hydroxy-1,4,5,6-tetrahydronicotinamide-adenine dinucleotide[1], (6S)-6-beta-hydroxy-1,4,5,6-tetrahydronicotinamide-adenine dinucleotide[1], (6S)-6beta-Hydroxy-1,4,5,6-tetrahydronicotinamide-adenine dinucleotide[1], (S)-NADH-hydrate[1], (S)-NADHX[1], 6beta-Hydroxy-1,4,5,6-tetrahydronicotinamide-adenine dinucleotide[1]
Data Sources: [0] CHEBI:64074 via ChEBI, [1] cpd02951 via ModelSEED
Linkouts
Data Sources: [0] CHEBI:64074 via ChEBI, [1] cpd02951 via ModelSEED
Alternative Component
nadhx__S:-1
  • (S)-NADHX(1-)
  • Charge: -1
  • Formula: C21H30N7O15P2
CHEBI:57458
  • (S)-NADHX(1-)
  • Type: Small Molecule
  • InChiKey: IDBZKGQRLBFUFQ-VPHRTNKSSA-M
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 682.4483[0]
  • SMILES: NC(=O)C1=C[NH+]([C@@H]2O[C@H](COP(=O)([O-])OP(=O)([O-])OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)[C@@H](O)CC1[0]
  • Names: (6S)-6-hydroxy-1,4,5,6-tetrahydronicotinamide adenine dinucleotide anion[0], adenosine 5'-(3-{5-[(2S)-5-carbamoyl-2-hydroxy-3,4-dihydropyridinium-1(2H)-yl]-5-deoxy-beta-D-ribofuranosyl} diphosphate)[0], (6S)-6-hydroxy-1,4,5,6-tetrahydronicotinamide adenine dinucleotide(1-)[0]
Data Sources: [0] CHEBI:57458 via ChEBI
Linkouts
Data Sources: [0] CHEBI:57458 via ChEBI
Alternative Component
nadhx__S:0
  • (S)-NADHX
  • Charge: 0
  • Formula: C21H31N7O15P2
CHEBI:44236
  • (S)-NADHX
  • Type: Small Molecule
  • InChiKey: IDBZKGQRLBFUFQ-VPHRTNKSSA-N
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 683.4563[0]
  • SMILES: NC(=O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)[C@@H](O)CC1[0]
  • Names: BETA-6-HYDROXY-1,4,5,6-TETRHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE[0], (6S)-6beta-hydroxy-1,4,5,6-tetrahydronicotinamide adenine dinucleotide[0], adenosine 5'-(3-{5-[(2S)-5-carbamoyl-2-hydroxy-3,4-dihydropyridin-1-yl]-5-deoxy-beta-D-ribofuranosyl} dihydrogen diphosphate)[0], 6beta-Hydroxy-1,4,5,6-tetrahydronicotinamide-adenine dinucleotide[0]
Data Sources: [0] CHEBI:44236 via ChEBI
Linkouts
Data Sources: [0] CHEBI:44236 via ChEBI
Alternative Component
nadhx__S:1
  • (S)-NADHX(1+)
  • Charge: 1
  • Formula: C21H32N7O15P2
CHEBI:15644
  • (S)-NADHX(1+)
  • Type: Small Molecule
  • InChiKey: IDBZKGQRLBFUFQ-VPHRTNKSSA-O
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 684.4642[0]
  • SMILES: [H][N+]1([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=C(C(N)=O)CC[C@@H]1O[0]
  • Names: (6S)-6-beta-Hydroxy-1,4,5,6-tetrahydronicotinamide-adenine dinucleotide[0], (6S)-6-beta-hydroxy-1,4,5,6-tetrahydronicotinamide-adenine dinucleotide[0], adenosine 5'-(3-{5-[(2S)-5-carbamoyl-2-hydroxy-3,4-dihydropyridinium-1(2H)-yl]-5-deoxy-beta-D-ribofuranosyl} dihydrogen diphosphate)[0]
Data Sources: [0] CHEBI:15644 via ChEBI
Linkouts
Data Sources: [0] CHEBI:15644 via ChEBI
Metabolite in Models
  BiGG ID Compartment Charge Model Organism
  BiGG ID Compartment Charge Model Organism