CHEBI:17963 - 1-methyl-4-phenyl-1,2,3,6-tetrahydropyridine

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ChEBI Name 1-methyl-4-phenyl-1,2,3,6-tetrahydropyridine ChEBI ID CHEBI:17963 Definition A tetrahydropyridine that is 1,2,3,6-tetrahydropyridine substituted by a methyl group at position 1 and a phenyl group at position 4. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:639, CHEBI:11263, CHEBI:19059 Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Wikipedia License Read full article at Wikipedia Formula C12H15N Net Charge 0 Average Mass 173.25424 Monoisotopic Mass 173.12045 InChI InChI=1S/C12H15N/c1-13-9-7-12(8-10-13)11-5-3-2-4-6-11/h2-7H,8-10H2,1H3 InChIKey PLRACCBDVIHHLZ-UHFFFAOYSA-N SMILES CN1CCC(=CC1)c1ccccc1 Roles Classification Biological Role(s): neurotoxin A poison that interferes with the functions of the nervous system. View more via ChEBI Ontology ChEBI Ontology Outgoing 1-methyl-4-phenyl-1,2,3,6-tetrahydropyridine (CHEBI:17963) has role neurotoxin (CHEBI:50910) 1-methyl-4-phenyl-1,2,3,6-tetrahydropyridine (CHEBI:17963) is a methylpyridines (CHEBI:25340) 1-methyl-4-phenyl-1,2,3,6-tetrahydropyridine (CHEBI:17963) is a phenylpyridine (CHEBI:38193) 1-methyl-4-phenyl-1,2,3,6-tetrahydropyridine (CHEBI:17963) is a tetrahydropyridine (CHEBI:26921) Incoming 1-methyl-4-phenyl-1,2,3,6-tetrahydropyridine N-oxide (CHEBI:17472) has functional parent 1-methyl-4-phenyl-1,2,3,6-tetrahydropyridine (CHEBI:17963) IUPAC Name 1-methyl-4-phenyl-1,2,3,6-tetrahydropyridine Synonyms Sources 1-Methyl-4-phenyl-1,2,3,6-tetrahydropyridine KEGG COMPOUND MPTP KEGG COMPOUND Manual Xrefs Databases C04599 KEGG COMPOUND MPTP Wikipedia View more database links Registry Numbers Types Sources 133712 Reaxys Registry Number Reaxys 28289-54-5 CAS Registry Number KEGG COMPOUND 28289-54-5 CAS Registry Number ChemIDplus Citations Types Sources 21798732 PubMed citation Europe PMC 21830164 PubMed citation Europe PMC 22393538 PubMed citation Europe PMC 23296790 PubMed citation Europe PMC Last Modified 18 January 2022