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CHEBI:188656 - disobutamide

ChEBI IDCHEBI:188656
ChEBI Namedisobutamide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H38ClN3O
Net Charge0
Average Mass408.030
Monoisotopic Mass407.27034
SMILESCC(C)N(CCC(CCN1CCCCC1)(C(N)=O)c1ccccc1Cl)C(C)C
InChIInChI=1S/C23H38ClN3O/c1-18(2)27(19(3)4)17-13-23(22(25)28,20-10-6-7-11-21(20)24)12-16-26-14-8-5-9-15-26/h6-7,10-11,18-19H,5,8-9,12-17H2,1-4H3,(H2,25,28)
InChIKeyYKFWMDHZMQLWBO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Phyllostachys violascens (ncbitaxon:1903417) stem (BTO:0001300) MetaboLights (MTBLS3970) Strain: Phyllostachys violascens cv. Viridisulcata
ChEBI Ontology
Outgoing Relation(s)
disobutamide (CHEBI:188656) is a acetamides (CHEBI:22160)
IUPAC Name 
2-(2-chlorophenyl)-2-[2-[di(propan-2-yl)amino]ethyl]-4-piperidin-1-ylbutanamide
Manual XrefsDatabases
D03871KEGG DRUG
61837ChemSpider
Registry NumbersSources
CAS:68284-69-5ChemIDplus