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CHEBI:81119 - D-Galacturonic acid calcium salt

ChEBI IDCHEBI:81119
ChEBI NameD-Galacturonic acid calcium salt
Stars
DownloadsMolfile
FormulaC12H18CaO14
Net Charge0
Average Mass426.340
Monoisotopic Mass426.03225
SMILESO=C[C@H](O)[C@@H](O)[C@@H](O)[C@H](O)C(=O)[O][Ca][O]C(=O)[C@@H](O)[C@H](O)[C@H](O)[C@@H](O)C=O
InChIInChI=1S/2C6H10O7.Ca/c2*7-1-2(8)3(9)4(10)5(11)6(12)13;/h2*1-5,8-11H,(H,12,13);/q;;+2/p-2/t2*2-,3+,4+,5-;/m00./s1
InChIKeyILJIJWPWFKABMW-PDCYBDDKSA-L
ChEBI Ontology
Outgoing Relation(s)
D-Galacturonic acid calcium salt (CHEBI:81119) is a carbohydrate acid derivative (CHEBI:63436)
Manual XrefsDatabases
C17477KEGG COMPOUND