MAGNESIUM GLYCEROPHOSPHATE
General Information
| Mainterm | MAGNESIUM GLYCEROPHOSPHATE |
| Doc Type | NUL |
| CAS Reg.No.(or other ID) | 927-20-8 |
| Regnum |
175.105 175.300 181.29 |
From www.fda.gov
Computed Descriptors
Download SDF| 2D Structure | |
| CID | 10012877 |
| IUPAC Name | magnesium;2,3-dihydroxypropyl phosphate |
| InChI | InChI=1S/C3H9O6P.Mg/c4-1-3(5)2-9-10(6,7)8;/h3-5H,1-2H2,(H2,6,7,8);/q;+2/p-2 |
| InChI Key | BHJKUVVFSKEBEX-UHFFFAOYSA-L |
| Canonical SMILES | C(C(COP(=O)([O-])[O-])O)O.[Mg+2] |
| Molecular Formula | C3H7MgO6P |
| Wikipedia | magnesium 1-glycerophosphate |
From Pubchem
Computed Properties
| Property Name | Property Value |
|---|---|
| Molecular Weight | 194.362 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 3 |
| Complexity | 117.0 |
| CACTVS Substructure Key Fingerprint | A A A D c Y B A O A I A A C A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A G g A A C C A A C B S g g A I A A A A A A x A A Q A A A A I A A A A A A A A A A A A A A A A A B E A A A A A A A Q A A B A A A B A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A = = |
| Topological Polar Surface Area | 113.0 |
| Monoisotopic Mass | 193.983 |
| Exact Mass | 193.983 |
| Compound Is Canonicalized | True |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Isotope Atom Count | 0 |
| Covalently-Bonded Unit Count | 2 |
From Pubchem
Taxonomic Classification
| Kingdom | Organic compounds |
|---|---|
| Superclass | Lipids and lipid-like molecules |
| Class | Glycerophospholipids |
| Subclass | Glycerophosphates |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Glycerophosphates |
| Alternative Parents | |
| Molecular Framework | Aliphatic acyclic compounds |
| 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 - Organic salt - Primary alcohol - Organooxygen compound - Alcohol - Aliphatic acyclic compound |
| Description | This compound belongs to the class of organic compounds known as glycerophosphates. These are compounds containing a glycerol linked to a phosphate group. |
From ClassyFire