sn-glycerol 1-phosphate (PAMDB120467)

IdentificationTaxonomyPhysical PropertiesBiological PropertiesSpectraConcentrationsLinksReferencesEnzymes Transporters
Proteins (3280)
Record Information
Version 1.0
Update Date 1/22/2018 11:54:54 AM
Metabolite IDPAMDB120467
Identification
Name: sn-glycerol 1-phosphate
Description:A glycerol 1-phosphate(2−) that is the dianion of sn-glycerol 1-phosphate arising from deprotonation of both phosphate OH groups.
Structure
Thumb
🔍MOLSDFPDBSMILESInChIView Structure
Synonyms:
  • sn-glycerol 1-phosphate
  • sn-glycerol 1-phosphate dianion
Chemical Formula: C3H7O6P
Average Molecular Weight: 170.058
Monoisotopic Molecular Weight: 172.01367
InChI Key: AWUCVROLDVIAJX-VKHMYHEASA-L
InChI:InChI=1S/C3H9O6P/c4-1-3(5)2-9-10(6,7)8/h3-5H,1-2H2,(H2,6,7,8)/p-2/t3-/m0/s1
CAS number: Not Available
IUPAC Name:(2S)-2,3-dihydroxypropyl phosphate
Traditional IUPAC Name: Not Available
SMILES:C(OP([O-])(=O)[O-])C(O)CO
Chemical Taxonomy
Taxonomy DescriptionThis compound belongs to the class of organic compounds known as glycerophosphates. These are compounds containing a glycerol linked to a phosphate group.
Kingdom Organic compounds
Super ClassLipids and lipid-like molecules
Class Glycerophospholipids
Sub ClassGlycerophosphates
Direct Parent Glycerophosphates
Alternative Parents
Substituents
  • Sn-glycerol-3-phosphate
  • Alkyl phosphate
  • Phosphoric acid ester
  • Organic phosphoric acid derivative
  • Secondary alcohol
  • 1,2-diol
  • Organic oxygen compound
  • Organic oxide
  • Hydrocarbon derivative
  • Primary alcohol
  • Organooxygen compound
  • Alcohol
  • Organic anion
  • Aliphatic acyclic compound
Molecular Framework Aliphatic acyclic compounds
External Descriptors
  • organophosphate oxoanion (CHEBI:231935)
  • a small molecule (SN-GLYCEROL-1-PHOSPHATE)
Physical Properties
State: Not Available
Charge:-2
Melting point: Not Available
Experimental Properties: Not Available
Predicted Properties
PropertyValueSource
3D Conformer7048685 PubChem
Molecular Weight170.057 g/molPubChem
XLogP3-AA-3 PubChem
Hydrogen Bond Donor Count2 PubChem
Hydrogen Bond Acceptor Count6 PubChem
Rotatable Bond Count3 PubChem
Exact Mass169.998 g/molPubChem
Monoisotopic Mass169.998 g/molPubChem
Topological Polar Surface Area113 A^2PubChem
Heavy Atom Count10 PubChem
Formal Charge-2 PubChem
Complexity117 PubChem
Isotope Atom Count0 PubChem
Defined Atom Stereocenter Count1 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:
L-1-PHOSPHATIDYL-GLYCEROL → sn-glycerol 1-phosphate
Pathways:
    Spectra
    Spectra: Not Available
    References
    References:
    Synthesis Reference: Not Available
    Material Safety Data Sheet (MSDS) Not Available
    External Links:
    ResourceLink
    CHEMSPIDER5408879
    CHEBI57685
    PUBCHEM7048685
    LIGAND-CPDC00623