| CAS Number | 33068-19-8 |
| Catalog Number | AG00C8BI(AGN-PC-00URLU) |
| Chemical Name | 2-Deoxy-D-glucose 6-phosphate sodium salt |
| IUPAC Name | sodium;(2,3,4-trihydroxy-6-oxohexyl) dihydrogen phosphate |
| InChI | InChI=1S/C6H13O8P.Na/c7-2-1-4(8)6(10)5(9)3-14-15(11,12)13;/h2,4-6,8-10H,1,3H2,(H2,11,12,13); |
| InChI Key | IZNJIWLEAMRBEY-UHFFFAOYSA-N |
| MDL Number | MFCD00057477 |
| Molecular Formula | C6H13NaO8P |
| Molecular Weight | 267.1262 |
| SMILES | C(C=O)[C@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O.[Na] |
| Synonyms | 33068-19-8,
DTXSID90585139,
PUBCHEM_16219287,
2-Deoxy-D-glucose 6-phosphate sodium salt,
2-Deoxy-D-glucose-6-phosphate sodium salt,
|
| Complexity | 237 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 267.025g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 8 |
| Hydrogen Bond Donor Count | 5 |
| Isotope Atom Count | 0 |
| Molecular Weight | 267.126g/mol |
| Monoisotopic Mass | 267.025g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 145A^2 |
| Undefined Atom Stereocenter Count | 3 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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