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Universal:4ppan

(R)-4'-phosphonatopantothenate(3-)

Default Component
4ppan:-3
  • (R)-4'-phosphonatopantothenate(3-)
  • Charge: -3
  • Formula: C9H15NO8P
CHEBI:10986
  • (R)-4'-phosphonatopantothenate(3-)
  • Type: Small Molecule
  • InChiKey: XHFVGHPGDLDEQO-ZETCQYMHSA-K
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 296.1911[0], 297.0[1]
  • SMILES: CC(C)(COP(=O)([O-])[O-])[C@@H](O)C(=O)NCCC(=O)[O-][0,1]
  • Names: 3-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonatooxy)butanamido]propanoate[0], (R)-4'-phosphopantothenate[0,1], 4-phosphopantothenate[1], (R)-4'-Phosphopantothenate[1], 4'-P-Pantothenate[1], 4'-phosphopantothenate[1], D-4'-Phosphopantothenate[1], D-4'-phosphopantothenate[1], D-4-Phosphopantothenate[1]
Data Sources: [0] CHEBI:10986 via ChEBI, [1] cpd02201 via ModelSEED
Linkouts
Data Sources: [0] CHEBI:10986 via ChEBI, [1] cpd02201 via ModelSEED
Alternative Component
4ppan:-2
  • (R)-4'-phosphopantothenate(2-)
  • Charge: -2
  • Formula: C9H16NO8P
CHEBI:20891
  • (R)-4'-phosphopantothenate(2-)
  • Type: Small Molecule
  • InChiKey: XHFVGHPGDLDEQO-ZETCQYMHSA-L
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 297.19904[0]
  • SMILES: CC(C)(COP(=O)([O-])O)[C@@H](O)C(=O)NCCC(=O)[O-][0]
  • Names: 3-[(2R)-2-hydroxy-4-[(hydroxyphosphinato)oxy]-3,3-dimethylbutanamido]propanoate[0]
Data Sources: [0] CHEBI:20891 via ChEBI
Linkouts
Data Sources: [0] CHEBI:20891 via ChEBI
Alternative Component
4ppan:-1
  • (R)-4'-phosphopantothenate(1-)
  • Charge: -1
  • Formula: C9H17NO8P
CHEBI:12886
  • (R)-4'-phosphopantothenate(1-)
  • Type: Small Molecule
  • InChiKey: XHFVGHPGDLDEQO-ZETCQYMHSA-M
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 298.20698[0]
  • SMILES: CC(C)(COP(=O)(O)O)[C@@H](O)C(=O)NCCC(=O)[O-][0]
  • Names: 3-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanamido]propanoate[0]
Data Sources: [0] CHEBI:12886 via ChEBI
Linkouts
Data Sources: [0] CHEBI:12886 via ChEBI
Alternative Component
4ppan:0
  • (R)-4'-phosphopantothenic acid
  • Charge: 0
  • Formula: C9H18NO8P
CHEBI:15905
  • (R)-4'-phosphopantothenic acid
  • Type: Small Molecule
  • InChiKey: XHFVGHPGDLDEQO-ZETCQYMHSA-N
  • View on ChEBI
Properties
  • Molecular Mass||g/mol: 299.21492[0]
  • SMILES: CC(C)(COP(=O)(O)O)[C@@H](O)C(=O)NCCC(=O)O[0]
  • Names: D-4'-Phosphopantothenate[0], (R)-4'-Phosphopantothenate[0], N-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanine[0], 3-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanamido]propanoic acid[0], (R)-N-(2-hydroxy-3,3-dimethyl-1-oxo-4-(phosphonooxy)butyl)-beta-alanine[0], phosphopantothenic acid[0]
Data Sources: [0] CHEBI:15905 via ChEBI
Linkouts
Data Sources: [0] CHEBI:15905 via ChEBI
Metabolite in Models
  BiGG ID Compartment Charge Model Organism
  BiGG ID Compartment Charge Model Organism