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ChEBI
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CHEBI:145128 - SKF-96365 free base(1+)
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ChEBI Name
SKF-96365 free base(1+)
ChEBI ID
CHEBI:145128
Definition
An organic cation obtained by protonation of the imidazole group of SKF-96365 free base.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C22H27N2O3
Net Charge
+1
Average Mass
367.468
Monoisotopic Mass
367.20162
InChI
InChI=1S/C22H26N2O3/c1-
25-
20-
9-
5-
18(6-
10-
20)
4-
3-
15-
27-
22(16-
24-
14-
13-
23-
17-
24)
19-
7-
11-
21(26-
2)
12-
8-
19/h5-
14,17,22H,3-
4,15-
16H2,1-
2H3/p+1
InChIKey
HLMBXBGDBBCYII-UHFFFAOYSA-O
SMILES
C=1(C=CC(=CC1)OC)C(CN2C=[NH+]C=C2)OCCCC3=CC=C(C=C3)OC
ChEBI Ontology
Outgoing
SKF-96365 free base(1+) (
CHEBI:145128
)
is a
organic cation (
CHEBI:25697
)
SKF-96365 free base(1+) (
CHEBI:145128
)
is conjugate acid of
SKF-96365 free base (
CHEBI:145122
)
Incoming
SKF-96365 hydrochloride (
CHEBI:145121
)
has part
SKF-96365 free base(1+) (
CHEBI:145128
)
SKF-96365 free base (
CHEBI:145122
)
is conjugate base of
SKF-96365 free base(1+) (
CHEBI:145128
)
IUPAC Name
1-{2-(4-methoxyphenyl)-2-[3-(4-methoxyphenyl)propoxy]ethyl}-1
H
-imidazol-3-ium
Synonym
Source
SKF-96365 cation
ChEBI
Last Modified
21 October 2019