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Barium bis[1-(hydroxymethyl)-5-oxopyrrolidine-2-carboxylate]
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
453.99591267200003
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₂H₁₆BaN₂O₈
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
O=C([O-])C1CCC(=O)N1CO.O=C([O-])C1CCC(=O)N1CO.[Ba+2]
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/2C6H9NO4.Ba/c2*8-3-7-4(6(10)11)1-2-5(7)9;/h2*4,8H,1-3H2,(H,10,11);/q;;+2/p-2
0 references
InChIKey
GJMYXPBQMBBXGA-UHFFFAOYSA-L
0 references
CAS Registry Number
95008-97-2
0 references
PubChem CID
44148069
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
GJMYXPBQMBBXGA-UHFFFAOYSA-L
UniChem compound ID
58710010
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50915175
1 reference
matched by identifier from
InChIKey
InChIKey
GJMYXPBQMBBXGA-UHFFFAOYSA-L
DSSTOX compound identifier
DTXCID801344154
0 references
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