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Details

Stereochemistry ACHIRAL
Molecular Formula C6H4O7.2Ca
Molecular Weight 268.248
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DICALCIUM CITRATE

SMILES

[Ca++].[Ca++].[O-]C(=O)CC([O-])(CC([O-])=O)C([O-])=O

InChI

InChIKey=GVBZXEURQOEPTG-UHFFFAOYSA-K
InChI=1S/C6H7O7.2Ca/c7-3(8)1-6(13,5(11)12)2-4(9)10;;/h1-2H2,(H,7,8)(H,9,10)(H,11,12);;/q-1;2*+2/p-3

HIDE SMILES / InChI

Molecular Formula C6H4O7
Molecular Weight 188.0918
Charge -4
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity ( + / - )

Molecular Formula Ca
Molecular Weight 40.078
Charge 2
Count
MOL RATIO 2 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
LGH2B6RC26
Record Status Validated (UNII)
Record Version