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> Main
CHEBI:157622 - buzepide(1+)
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ChEBI Name
buzepide(1+)
ChEBI ID
CHEBI:157622
Definition
A tertiary ammonium ion that is the conjugate acid of buzepide, resulting from the protonation of the azepane tertiary amino group. Major microspecies at pH 7.3.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C22H29N2O
Net Charge
+1
Average Mass
337.486
Monoisotopic Mass
337.22744
InChI
InChI=1S/C22H28N2O/c23-
21(25)
22(19-
11-
5-
3-
6-
12-
19,20-
13-
7-
4-
8-
14-
20)
15-
18-
24-
16-
9-
1-
2-
10-
17-
24/h3-
8,11-
14H,1-
2,9-
10,15-
18H2,(H2,23,25)
/p+1
InChIKey
SLJXUJZUTPFXRJ-UHFFFAOYSA-O
SMILES
NC(=O)C(CC[NH+]1CCCCCC1)(C1=CC=CC=C1)C1=CC=CC=C1
ChEBI Ontology
Outgoing
buzepide(1+) (
CHEBI:157622
)
is a
tertiary ammonium ion (
CHEBI:137982
)
buzepide(1+) (
CHEBI:157622
)
is conjugate acid of
buzepide (
CHEBI:157619
)
Incoming
buzepide metiodide (
CHEBI:135429
)
has part
buzepide(1+) (
CHEBI:157622
)
buzepide (
CHEBI:157619
)
is conjugate base of
buzepide(1+) (
CHEBI:157622
)
IUPAC Name
1-(4-amino-4-oxo-3,3-diphenylbutyl)azepanium
Synonyms
Sources
1-(4-amino-4-oxo-3,3-diphenylbutyl)azepan-1-ium
IUPAC
buzepide cation
ChEBI
Last Modified
09 October 2020