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CHEBI:93890 - 1-[2-(1-adamantyl)ethoxy]-3-(4-methyl-1-piperazinyl)-2-propanol

ChEBI IDCHEBI:93890
ChEBI Name1-[2-(1-adamantyl)ethoxy]-3-(4-methyl-1-piperazinyl)-2-propanol
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DownloadsMolfile
FormulaC20H36N2O2
Net Charge0
Average Mass336.520
Monoisotopic Mass336.27768
SMILESCN1CCN(CC(O)COCCC23CC4CC(CC(C4)C2)C3)CC1
InChIInChI=1S/C20H36N2O2/c1-21-3-5-22(6-4-21)14-19(23)15-24-7-2-20-11-16-8-17(12-20)10-18(9-16)13-20/h16-19,23H,2-15H2,1H3
InChIKeyDNEUNQHNKDREAR-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
1-[2-(1-adamantyl)ethoxy]-3-(4-methyl-1-piperazinyl)-2-propanol (CHEBI:93890) is a N-methylpiperazine (CHEBI:46920)
Manual XrefsDatabases
LSM-4465LINCS