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CHEBI:135153 - sodium gualenate

ChEBI IDCHEBI:135153
ChEBI Namesodium gualenate
Stars
Last Modified23 February 2017
DownloadsMolfile
FormulaC15H18O3S
Net Charge0
Average Mass278.373
Monoisotopic Mass278.09767
SMILESCc1cc(S(=O)(=O)O)c2c(C)ccc(C(C)C)cc1-2
InChIInChI=1S/C15H18O3S/c1-9(2)12-6-5-10(3)15-13(8-12)11(4)7-14(15)19(16,17)18/h5-9H,1-4H3,(H,16,17,18)
InChIKeyVIZXMHCBZLGUET-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
sodium gualenate (CHEBI:135153) is a sesquiterpenoid (CHEBI:26658)
Synonyms  Source
guaiazulenesulfonic acid sodiumDrugCentral
sodium guaiazulenesulfonateDrugCentral
azulene sulfonateDrugCentral
Manual XrefsDatabases
3874DrugCentral
Registry NumbersSources
CAS:6223-35-4DrugCentral