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CHEBI:31346 - calcium sulfate

ChEBI IDCHEBI:31346
ChEBI Namecalcium sulfate
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaCa.O4S
Net Charge0
Average Mass136.141
Monoisotopic Mass135.91432
SMILESO=S(=O)([O-])[O-].[Ca+2]
InChIInChI=1S/Ca.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2
InChIKeyOSGAYBCDTDRGGQ-UHFFFAOYSA-L
Roles Classification
Biological Role:
nutrient  A nutrient is a food component that an organism uses to survive and grow.
ChEBI Ontology
Outgoing Relation(s)
calcium sulfate (CHEBI:31346) is a calcium salt (CHEBI:35156)
calcium sulfate (CHEBI:31346) is a inorganic calcium salt (CHEBI:190295)
Incoming Relation(s)
calcium sulfate dihydrate (CHEBI:32583) has part calcium sulfate (CHEBI:31346)
IUPAC Name 
calcium sulfate
Synonyms  Source
anhydrous gypsumNIST Chemistry WebBook
Calcium sulfateKEGG COMPOUND
calcium sulfate, anhydrousNIST Chemistry WebBook
calcium sulphateChEBI
CaSO4IUPAC
KalziumsulfatChEBI
Manual XrefsDatabases
C13194KEGG COMPOUND
D09201KEGG DRUG
Registry NumbersSources
CAS:7778-18-9KEGG COMPOUND
CAS:7778-18-9NIST Chemistry WebBook
CAS:7778-18-9ChemIDplus