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CHEBI:168619 - Hydroxyhexamide

ChEBI IDCHEBI:168619
ChEBI NameHydroxyhexamide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22N2O4S
Net Charge0
Average Mass326.418
Monoisotopic Mass326.13003
SMILESCC(O)c1ccc(S(=O)(=O)NC(=O)NC2CCCCC2)cc1
InChIInChI=1S/C15H22N2O4S/c1-11(18)12-7-9-14(10-8-12)22(20,21)17-15(19)16-13-5-3-2-4-6-13/h7-11,13,18H,2-6H2,1H3,(H2,16,17,19)
InChIKeyVQDAEOYLIBGCHE-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
Hydroxyhexamide (CHEBI:168619) is a sulfonamide (CHEBI:35358)
IUPAC Name 
1-cyclohexyl-3-[4-(1-hydroxyethyl)phenyl]sulonylurea
Manual XrefsDatabases
HMDB0060610HMDB
17470ChemSpider
Registry NumbersSources
CAS:3168-01-2ChemIDplus