CHEBI:183638 - ketanserin(1+)

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ChEBI Name ketanserin(1+) ChEBI ID CHEBI:183638 Definition A piperidinium ion obtained by protonation of the piperidine nitrogen of ketanserin; major microspecies at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C22H23FN3O3 Net Charge +1 Average Mass 396.442 Monoisotopic Mass 396.17180 InChI InChI=1S/C22H22FN3O3/c23-17-7-5-15(6-8-17)20(27)16-9-11-25(12-10-16)13-14-26-21(28)18-3-1-2-4-19(18)24-22(26)29/h1-8,16H,9-14H2,(H,24,29)/p+1 InChIKey FPCCSQOGAWCVBH-UHFFFAOYSA-O SMILES FC1=CC=C(C=C1)C(=O)C1CC[NH+](CCN2C(=O)NC3=CC=CC=C3C2=O)CC1 ChEBI Ontology Outgoing ketanserin(1+) (CHEBI:183638) is a piperidinium ion (CHEBI:48633) ketanserin(1+) (CHEBI:183638) is conjugate acid of ketanserin (CHEBI:6123) Incoming ketanserin tartrate (CHEBI:183637) has part ketanserin(1+) (CHEBI:183638) ketanserin (CHEBI:6123) is conjugate base of ketanserin(1+) (CHEBI:183638) IUPAC Name 1-[2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)ethyl]-4-(4-fluorobenzoyl)piperidinium Synonym Source ketanserin cation ChEBI Last Modified 09 November 2021