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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.

Term:EDTA monocalcium salt
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Accession:CHEBI:132317 term browser browse the term
Definition:An organic calcium salt that is the monocalcium salt of ethylenediaminetetraacetic acid (EDTA).
Synonyms:exact_synonym: calcium 2,2',2'',2'''-(ethane-1,2-diyldiazaniumyl)tetraacetate
 related_synonym: Calcium dihydrogen ethylenediaminetetraacetate;   Edetate monocalcium;   Formula=C10H14CaN2O8;   InChI=1S/C10H16N2O8.Ca/c13-7(14)3-11(4-8(15)16)1-2-12(5-9(17)18)6-10(19)20;/h1-6H2,(H,13,14)(H,15,16)(H,17,18)(H,19,20);/q;+2/p-2;   InChIKey=NVTRPRFAWJGJAJ-UHFFFAOYSA-L;   SMILES=O=C([O-])C[NH+](CC(=O)[O-])CC[NH+](CC(=O)[O-])CC(=O)[O-].[Ca+2]
 xref: CAS:12264-18-5;   Chemspider:2628914



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  CHEBI ontology 0
    role 0
      chemical role 0
        ligand 0
          chelator 0
            EDTA monocalcium salt 0
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  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    main group molecular entity 0
                      s-block molecular entity 0
                        alkaline earth molecular entity 0
                          calcium molecular entity 0
                            elemental calcium 0
                              calcium ion 0
                                calcium cation 0
                                  calcium(2+) 0
                                    calcium salt 0
                                      organic calcium salt 0
                                        EDTA monocalcium salt 0
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