93857-17-1 Purity
96%
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Specification
The molecular formula of Sodium 3-deoxygluconate is C6H11NaO6.
The synonyms of Sodium 3-deoxygluconate are Sodium 3-deoxyhexonate and DTXSID00917447.
The molecular weight of Sodium 3-deoxygluconate is 202.14 g/mol.
The parent compound of Sodium 3-deoxygluconate is CID 14122626 (3-Deoxy-d-ribo-hexonic acid).
The IUPAC name of Sodium 3-deoxygluconate is sodium;(2R,4S,5R)-2,4,5,6-tetrahydroxyhexanoate.
The InChI of Sodium 3-deoxygluconate is InChI=1S/C6H12O6.Na/c7-2-5(10)3(8)1-4(9)6(11)12;/h3-5,7-10H,1-2H2,(H,11,12);/q;+1/p-1/t3-,4+,5+;/m0./s1.
The InChIKey of Sodium 3-deoxygluconate is ZRBXQRZQHABLKN-UJPDDDSFSA-M.
The canonical SMILES of Sodium 3-deoxygluconate is C(C(C(CO)O)O)C(C(=O)[O-])O.[Na+].
The CAS number of Sodium 3-deoxygluconate is 93857-41-1.
The formal charge of Sodium 3-deoxygluconate is 0.