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CHEBI:5551 - Guaifenesin

Default Structure
ChEBI IDCHEBI:5551
ChEBI NameGuaifenesin
Stars
Secondary ChEBI IDCHEBI:91952
Last Modified6 March 2017
DownloadsMolfile
FormulaC10H14O4
Net Charge0
Average Mass198.218
Monoisotopic Mass198.08921
SMILESCOc1ccccc1OCC(O)CO
InChIInChI=1S/C10H14O4/c1-13-9-4-2-3-5-10(9)14-7-8(12)6-11/h2-5,8,11-12H,6-7H2,1H3
InChIKeyHSRJKNPTNIJEKV-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Guaifenesin (CHEBI:5551) is a methoxybenzenes (CHEBI:51683)
Synonyms  Source
glycerin guaiacolateDrugCentral
glycerol guaiacolateDrugCentral
GuaifenesinKEGG COMPOUND
guaifenesineDrugCentral
guaiphenesinDrugCentral
guaiphenesineDrugCentral
Manual XrefsDatabases
1336DrugCentral
D00337KEGG DRUG
HMDB0004998HMDB
LSM-1896LINCS
Registry NumbersSources
CAS:93-14-1KEGG COMPOUND
CAS:93-14-1DrugCentral