CHEBI:190513 - calcium citrate

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ChEBI Name calcium citrate
ChEBI ID CHEBI:190513
Definition An organic calcium salt composed of calcium cations and citrate anions in a 3:2 ratio.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Liliana Andres
Secondary ChEBI IDs CHEBI:3313
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Formulae 2C6H5O7.3Ca
C6H5O7.C6H5O7.Ca.Ca.Ca
Net Charge 0
Average Mass 498.432
Monoisotopic Mass 497.89483
InChI InChI=1S/2C6H8O7.3Ca/c2*7-3(8)1-6(13,5(11)12)2-4(9)10;;;/h2*13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;;/q;;3*+2/p-6
InChIKey FNAQSUUGMSOBHW-UHFFFAOYSA-H
SMILES [Ca++].[Ca++].[Ca++].OC(CC([O-])=O)(CC([O-])=O)C([O-])=O.OC(CC([O-])=O)(CC([O-])=O)C([O-])=O
Roles Classification
Biological Role(s): food additive
Any substance which is added to food to preserve or enhance its flavour and/or appearance.
food preservative
Substances which are added to food in order to prevent decomposition caused by microbial growth or by undesirable chemical changes.
flavouring agent
A food additive that is used to added improve the taste or odour of a food.
Application(s): nutraceutical
A product in capsule, tablet or liquid form that provide essential nutrients, such as a vitamin, an essential mineral, a protein, an herb, or similar nutritional substance.
food additive
Any substance which is added to food to preserve or enhance its flavour and/or appearance.
food preservative
Substances which are added to food in order to prevent decomposition caused by microbial growth or by undesirable chemical changes.
flavouring agent
A food additive that is used to added improve the taste or odour of a food.
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ChEBI Ontology
Outgoing calcium citrate (CHEBI:190513) has part citrate(3−) (CHEBI:16947)
calcium citrate (CHEBI:190513) has role flavouring agent (CHEBI:35617)
calcium citrate (CHEBI:190513) has role food additive (CHEBI:64047)
calcium citrate (CHEBI:190513) has role food preservative (CHEBI:65255)
calcium citrate (CHEBI:190513) has role nutraceutical (CHEBI:50733)
calcium citrate (CHEBI:190513) is a organic calcium salt (CHEBI:51031)
IUPAC Names
calcium 2-hydroxypropane-1,2,3-tricarboxylate (3/2)
calcium 2-hydroxypropane-1,2,3-tricarboxylate (3:2)
Synonyms Sources
2-hydroxy-1,2,3-propanetricarboxylic acid calcium salt (2:3) ChemIDplus
calcium 2-hydroxy-1,2,3-propanetricarboxylate (3:2) ChemIDplus
calcium citrate tribasic ChEBI
calcium citrate, tribasic ChemIDplus
citric acid calcium salt (2:3) ChemIDplus
tribasic calcium citrate ChemIDplus
tricalcium bis(2-hydroxypropane-1,2,3-tricarboxylic acid) HMDB
tricalcium bis(citric acid) HMDB
tricalcium citrate ChemIDplus
tricalcium dicitrate ChemIDplus
Brand Names Sources
Acicontral ChemIDplus
Calcitrate ChemIDplus
Manual Xrefs Databases
12584 ChemSpider
Calcium_citrate Wikipedia
DB11093 DrugBank
FDB013368 FooDB
HMDB0303432 HMDB
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Registry Number Type Source
813-94-5 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
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Last Modified
30 March 2022