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Barium Di-D-Gluconate
[CAS# 22561-74-6]

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CAS#: 22561-74-6
Product: Barium Di-D-Gluconate
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Identification
Name Barium Di-D-Gluconate
Synonyms Barium Di-D-Gluconate
Molecular Structure CAS#: 22561-74-6, Barium Di-D-Gluconate
Molecular Formula C12H22BaO14
Molecular Weight 527.64
CAS Registry Number 22561-74-6
EINECS 245-081-5
SMILES [C@H](O)([C@H](O)[C@H](O)CO)[C@@H](O)C([O-])=O.[C@H](O)([C@H](O)[C@H](O)CO)[C@@H](O)C([O-])=O.[Ba++]
InChI 1S/2C6H12O7.Ba/c2*7-1-2(8)3(9)4(10)5(11)6(12)13;/h2*2-5,7-11H,1H2,(H,12,13);/q;;+2/p-2/t2*2-,3-,4+,5-;/m11./s1
InChIKey PECPTSUHUFWKDG-IYEMJOQQSA-L
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