D-galactosamine 6-phosphate (PAMDB120201)

IdentificationTaxonomyPhysical PropertiesBiological PropertiesSpectraConcentrationsLinksReferencesEnzymes Transporters
Proteins (3280)
Record Information
Version 1.0
Update Date 1/22/2018 11:54:54 AM
Metabolite IDPAMDB120201
Identification
Name: D-galactosamine 6-phosphate
Description:An organophosphate oxoanion that is the conjugate base of D-galactosamine 6-phosphate, obtained by deprotonation of the phosphate OH groups and protonation of the 2-amino group. Major structure at pH 7.3.
Structure
Thumb
🔍MOLSDFPDBSMILESInChIView Structure
Synonyms:Not Available
Chemical Formula: C6H13NO8P
Average Molecular Weight: 258.144
Monoisotopic Molecular Weight: 260.05353
InChI Key: XHMJOUIAFHJHBW-GASJEMHNSA-M
InChI:InChI=1S/C6H14NO8P/c7-3-5(9)4(8)2(15-6(3)10)1-14-16(11,12)13/h2-6,8-10H,1,7H2,(H2,11,12,13)/p-1/t2-,3-,4+,5-,6?/m1/s1
CAS number: Not Available
IUPAC Name:2-azaniumyl-2-deoxy-6-O-phosphonato-D-galactopyranose
Traditional IUPAC Name: Not Available
SMILES:C(OP(=O)([O-])[O-])C1(OC(O)C([N+])C(O)C(O)1)
Chemical Taxonomy
Taxonomy DescriptionThis compound belongs to the class of organic compounds known as hexose phosphates. These are carbohydrate derivatives containing a hexose substituted by one or more phosphate groups.
Kingdom Organic compounds
Super ClassOrganic oxygen compounds
Class Organooxygen compounds
Sub ClassCarbohydrates and carbohydrate conjugates
Direct Parent Hexose phosphates
Alternative Parents
Substituents
  • Hexose phosphate
  • Monosaccharide phosphate
  • Amino saccharide
  • Organic phosphoric acid derivative
  • Oxane
  • Phosphoric acid ester
  • Alkyl phosphate
  • 1,2-diol
  • Hemiacetal
  • Secondary alcohol
  • Oxacycle
  • Organoheterocyclic compound
  • Polyol
  • Organonitrogen compound
  • Organic nitrogen compound
  • Hydrocarbon derivative
  • Organic oxide
  • Organopnictogen compound
  • Alcohol
  • Organic anion
  • Aliphatic heteromonocyclic compound
Molecular Framework Aliphatic heteromonocyclic compounds
External Descriptors Not Available
Physical Properties
State: Not Available
Charge:-1
Melting point: Not Available
Experimental Properties: Not Available
Predicted Properties
PropertyValueSource
Molecular Weight258.143 g/molPubChem
XLogP3-AA-6.9 PubChem
Hydrogen Bond Donor Count4 PubChem
Hydrogen Bond Acceptor Count8 PubChem
Rotatable Bond Count2 PubChem
Exact Mass258.038 g/molPubChem
Monoisotopic Mass258.038 g/molPubChem
Topological Polar Surface Area170 A^2PubChem
Heavy Atom Count16 PubChem
Formal Charge-1 PubChem
Complexity270 PubChem
Isotope Atom Count0 PubChem
Defined Atom Stereocenter Count5 PubChem
Undefined Atom Stereocenter Count0 PubChem
Defined Bond Stereocenter Count0 PubChem
Undefined Bond Stereocenter Count0 PubChem
Covalently-Bonded Unit Count1 PubChem
Biological Properties
Cellular Locations: Not Available
Reactions:
Water + N-acetyl-D-galactosamine 6-phosphate → acetate + D-galactosamine 6-phosphate
Pathways:
    Spectra
    Spectra: Not Available
    References
    References:
    Synthesis Reference: Not Available
    Material Safety Data Sheet (MSDS) Not Available
    External Links:
    ResourceLink
    CHEBI71674
    PUBCHEM44229145
    LIGAND-CPDC06377