EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:94797 - (3R,5S)-3,5-dimethyl-1-adamantanamine

ChEBI IDCHEBI:94797
ChEBI Name(3R,5S)-3,5-dimethyl-1-adamantanamine
Stars
DownloadsMolfile
FormulaC12H21N
Net Charge0
Average Mass179.307
Monoisotopic Mass179.16740
SMILESC[C@]12CC3CC(N)(C1)C[C@@](C)(C3)C2
InChIInChI=1S/C12H21N/c1-10-3-9-4-11(2,6-10)8-12(13,5-9)7-10/h9H,3-8,13H2,1-2H3/t9?,10-,11+,12?
InChIKeyBUGYDGFZZOZRHP-WSVSKBAQSA-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)
(3R,5S)-3,5-dimethyl-1-adamantanamine (CHEBI:94797) is a alkylamine (CHEBI:13759)
Manual XrefsDatabases
LSM-5966LINCS