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CHEBI:132317 - EDTA monocalcium salt
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ChEBI Name
EDTA monocalcium salt
ChEBI ID
CHEBI:132317
Definition
An organic calcium salt that is the monocalcium salt of ethylenediaminetetraacetic acid (EDTA).
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This entity has been manually annotated by the ChEBI Team.
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Formula
C10H14CaN2O8
Net Charge
0
Average Mass
330.305
Monoisotopic Mass
330.03761
InChI
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]
Metabolite of Species
Details
Ovis aries
(NCBI:txid9940)
See:
MetaboLights Study
Ovis aries
(NCBI:txid9940)
See:
PubMed
Roles Classification
Chemical Role
(s):
chelator
A ligand with two or more separate binding sites that can bind to a single metallic central atom, forming a chelate.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
EDTA monocalcium salt (
CHEBI:132317
)
has part
EDTA(2−) (
CHEBI:64755
)
EDTA monocalcium salt (
CHEBI:132317
)
has role
chelator (
CHEBI:38161
)
EDTA monocalcium salt (
CHEBI:132317
)
is a
organic calcium salt (
CHEBI:51031
)
IUPAC Name
calcium 2,2',2'',2'''-(ethane-1,2-diyldiazaniumyl)tetraacetate
Synonyms
Sources
Calcium dihydrogen ethylenediaminetetraacetate
ChemIDplus
Edetate monocalcium
ChemIDplus
Manual Xref
Database
2628914
ChemSpider
View more database links
Registry Number
Type
Source
12264-18-5
CAS Registry Number
ChemIDplus
Last Modified
12 January 2017