CALCIUM CITRATE

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Synonyms:	Calcimax Calcium (as citrate) Calcium citrate Calcium citrate anhydrous Calcium citrate tetrahydrate Citracal E-333(III) INS-333(III) INS NO.333(III) Tricalcium citrate tetrahydrate
Status:	Approved
Entry Type:	Small molecule
Molecule Category:	Salt
ATC:	A12AA13
UNII:	86117BWO7P
Parent Compound:	CALCIUM

Structure


InChI Key	FNAQSUUGMSOBHW-UHFFFAOYSA-H
Smile	O=C([O-])CC(O)(CC(=O)[O-])C(=O)[O-].O=C([O-])CC(O)(CC(=O)[O-])C(=O)[O-].[Ca+2].[Ca+2].[Ca+2]
InChI	InChI=1S/2C6H8O7.3Ca/c27-3(8)1-6(13,5(11)12)2-4(9)10;;;/h213H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;;/q;;3*+2/p-6

Physicochemical Descriptors

Property Name	Value
Molecular Formula	C12H10Ca3O14
Molecular Weight	498.43
AlogP	None
Hydrogen Bond Acceptor	None
Hydrogen Bond Donor	None
Number of Rotational Bond	None
Polar Surface Area	None
Molecular species	None
Aromatic Rings	None
Heavy Atoms	None

Indications

Mesh Heading	Maximum Phase	Mesh ID	Reference
Dental Caries	0	D003731	ClinicalTrials

Related Entries

Parent

Cross References

Resources	Reference
CAS NUMBER	813-94-5
ChEMBL	CHEMBL2106123
DrugBank	DB11093
EPA CompTox	DTXSID7061148
FDA SRS	86117BWO7P
PubChem	5282392
SureChEMBL	SCHEMBL29775

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