CHEBI:16804 - (RS)-1-benzyl-1,2,3,4-tetrahydroisoquinoline

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (RS)-1-benzyl-1,2,3,4-tetrahydroisoquinoline
ChEBI ID CHEBI:16804
ChEBI ASCII Name (RS)-1-benzyl-1,2,3,4-tetrahydroisoquinoline
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:28730, CHEBI:11019, CHEBI:364, CHEBI:18716, CHEBI:363
Supplier Information
Download Molfile XML SDF
Formula C16H17N
Net Charge 0
Average Mass 223.31292
Monoisotopic Mass 223.13610
InChI InChI=1S/C16H17N/c1-2-6-13(7-3-1)12-16-15-9-5-4-8-14(15)10-11-17-16/h1-9,16-17H,10-12H2
InChIKey YRYCIFUZSUMAAY-UHFFFAOYSA-N
SMILES C1Cc2ccccc2C(Cc2ccccc2)N1
ChEBI Ontology
Outgoing (RS)-1-benzyl-1,2,3,4-tetrahydroisoquinoline (CHEBI:16804) is a benzyltetrahydroisoquinoline (CHEBI:26901)
(RS)-1-benzyl-1,2,3,4-tetrahydroisoquinoline (CHEBI:16804) is conjugate base of 1-benzyl-1,2,3,4-tetrahydroisoquinolin-2-ium (CHEBI:57902)
Incoming 1-benzyl-1,2,3,4-tetrahydroisoquinolin-2-ium (CHEBI:57902) is conjugate acid of (RS)-1-benzyl-1,2,3,4-tetrahydroisoquinoline (CHEBI:16804)
IUPAC Name
rac-(1R)-1-benzyl-1,2,3,4-tetrahydroisoquinoline
Synonyms Sources
(R,S)-Tetrahydrobenzylisoquinoline KEGG COMPOUND
(RS)-1-Benzyl-1,2,3,4-tetrahydroisoquinoline KEGG COMPOUND
1,2,3,4-Tetrahydro-1-(phenylmethyl)isoquinoline ChemIDplus
1BnTIQ ChemIDplus
Manual Xref Database
C05201 KEGG COMPOUND
View more database links
Registry Number Type Source
19716-56-4 CAS Registry Number ChemIDplus
Last Modified
23 October 2015