CHEBI:15979 - 1-benzyl-2-methyl-1,2,3,4-tetrahydroisoquinoline

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1-benzyl-2-methyl-1,2,3,4-tetrahydroisoquinoline
ChEBI ID CHEBI:15979
Definition A benzyltetrahydroisoquinoline having the benzyl group at the 1-position and an N-methyl substituent.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:12604, CHEBI:21748, CHEBI:7304, CHEBI:7305, CHEBI:28056
Supplier Information
Download Molfile XML SDF
Formula C17H19N
Net Charge 0
Average Mass 237.33950
Monoisotopic Mass 237.15175
InChI InChI=1S/C17H19N/c1-18-12-11-15-9-5-6-10-16(15)17(18)13-14-7-3-2-4-8-14/h2-10,17H,11-13H2,1H3
InChIKey VKRKVLLLTIHDEF-UHFFFAOYSA-N
SMILES CN1CCc2ccccc2C1Cc1ccccc1
ChEBI Ontology
Outgoing 1-benzyl-2-methyl-1,2,3,4-tetrahydroisoquinoline (CHEBI:15979) is a benzyltetrahydroisoquinoline (CHEBI:26901)
1-benzyl-2-methyl-1,2,3,4-tetrahydroisoquinoline (CHEBI:15979) is conjugate base of 1-benzyl-2-methyl-1,2,3,4-tetrahydroisoquinolinium (CHEBI:57598)
Incoming (R)-1-benzyl-2-methyl-1,2,3,4-tetrahydroisoquinoline (CHEBI:48351) is a 1-benzyl-2-methyl-1,2,3,4-tetrahydroisoquinoline (CHEBI:15979)
(S)-1-benzyl-2-methyl-1,2,3,4-tetrahydroisoquinoline (CHEBI:48352) is a 1-benzyl-2-methyl-1,2,3,4-tetrahydroisoquinoline (CHEBI:15979)
1-benzyl-2-methyl-1,2,3,4-tetrahydroisoquinolinium (CHEBI:57598) is conjugate acid of 1-benzyl-2-methyl-1,2,3,4-tetrahydroisoquinoline (CHEBI:15979)
IUPAC Name
1-benzyl-2-methyl-1,2,3,4-tetrahydroisoquinoline
Synonyms Sources
N-Methyl-(R,S)-tetrahydrobenzylisoquinoline KEGG COMPOUND
N-Methyl-(R,S)-tetrahydrobenzylisoquinoline KEGG COMPOUND
N-Methyl-(RS)-1-benzyl-1,2,3,4-tetrahydroisoquinoline KEGG COMPOUND
N-methyl-1-benzyl-1,2,3,4-tetrahydroisoquinoline ChEBI
Manual Xref Database
C05314 KEGG COMPOUND
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Registry Numbers Types Sources
178433 Beilstein Registry Number Beilstein
84966 Beilstein Registry Number Beilstein
Last Modified
20 July 2010