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CHEBI:192136 - 4'-hydroxytrazodone

ChEBI IDCHEBI:192136
ChEBI Name4'-hydroxytrazodone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H22ClN5O2
Net Charge0
Average Mass387.871
Monoisotopic Mass387.14620
SMILESO=c1n(CCCN2CCN(c3ccc(O)c(Cl)c3)CC2)nc2ccccn12
InChIInChI=1S/C19H22ClN5O2/c20-16-14-15(5-6-17(16)26)23-12-10-22(11-13-23)7-3-9-25-19(27)24-8-2-1-4-18(24)21-25/h1-2,4-6,8,14,26H,3,7,9-13H2
InChIKeyFNUZSRSXQFIOPL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Marine plankton environmental sample (ncbitaxon:632957) - MetaboLights (MTBLS4424) Found in endometabolome.
ChEBI Ontology
Outgoing Relation(s)
4'-hydroxytrazodone (CHEBI:192136) is a piperazines (CHEBI:26144)
IUPAC Name 
2-[3-[4-(3-chloro-4-hydroxyphenyl)piperazin-1-yl]propyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one
Manual XrefsDatabases
HMDB0061060HMDB
22547087ChemSpider
Registry NumbersSources
CAS:53818-10-3ChemIDplus