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CHEBI:72567 - levobunolol(1+)

ChEBI IDCHEBI:72567
ChEBI Namelevobunolol(1+)
Stars
DefinitionAn organic cation obtained by protonation of the secondary amino function of levobunolol.
Last Modified23 August 2024
SubmitterSteve
DownloadsMolfile
FormulaC17H26NO3
Net Charge+1
Average Mass292.399
Monoisotopic Mass292.19072
SMILESCC(C)(C)[NH2+]C[C@H](O)COc1cccc2c1CCCC2=O
InChIInChI=1S/C17H25NO3/c1-17(2,3)18-10-12(19)11-21-16-9-5-6-13-14(16)7-4-8-15(13)20/h5-6,9,12,18-19H,4,7-8,10-11H2,1-3H3/p+1/t12-/m0/s1
InChIKeyIXHBTMCLRNMKHZ-LBPRGKRZSA-O
ChEBI Ontology
Outgoing Relation(s)
levobunolol(1+) (CHEBI:72567) is a ammonium ion derivative (CHEBI:35274)
levobunolol(1+) (CHEBI:72567) is a organic cation (CHEBI:25697)
levobunolol(1+) (CHEBI:72567) is conjugate acid of levobunolol (CHEBI:6438)
Incoming Relation(s)
levobunolol hydrochloride (CHEBI:6439) has part levobunolol(1+) (CHEBI:72567)
levobunolol (CHEBI:6438) is conjugate base of levobunolol(1+) (CHEBI:72567)
IUPAC Name 
(2S)-N-tert-butyl-2-hydroxy-3-[(5-oxo-5,6,7,8-tetrahydronaphthalen-1-yl)oxy]propan-1-aminium
Synonym  Source
levobunolol cationChEBI