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calcium erythorbate

Structure via PubChem · Public domain (PubChem)

EntityQ5018831· pop 7· linked from 80 articles

calcium erythorbate

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Also known as calcium isoascorbate

chemical compound

Chemical data

Formula
C12H14CaO12
Molecular weight
390.31 g/mol
IUPAC name
calcium bis((2R)-2-[(1R)-1,2-dihydroxyethyl]-3-hydroxy-5-oxo-2H-furan-4-olate)
SMILES
C([C@H]([C@@H]1C(=C(C(=O)O1)[O-])O)O)O.C([C@H]([C@@H]1C(=C(C(=O)O1)[O-])O)O)O.[Ca+2]
InChIKey
BLORRZQTHNGFTI-ZQGCMTCUSA-L
Polar surface area
220 Ų
H-bond donors
6
H-bond acceptors
12
Formal charge
0

via PubChem

Wikidata facts

Mass
390.01111686799993
Show 3 more facts
isomeric SMILES
OC1=C([O-])[C@]([C@H](O)CO)([H])OC1=O.OC1=C([O-])[C@]([C@H](O)CO)([H])OC1=O.[Ca+2]
chemical formula
C₁₂H₁₄CaO₁₂
canonical SMILES
O=C1OC(C(O)CO)C([O-])=C1O.O=C1OC(C(O)CO)C([O-])=C1O.[Ca+2]
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