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CHEBI:15944 - 6-O-methylnorlaudanosoline

Default Structure
ChEBI IDCHEBI:15944
ChEBI Name6-O-methylnorlaudanosoline
Stars
ASCII Name6-O-methylnorlaudanosoline
DefinitionThe 6-O-methyl derivative of norlaudanosoline.
Secondary ChEBI IDsCHEBI:2223, CHEBI:12198
Last Modified19 July 2010
DownloadsMolfile
FormulaC17H19NO4
Net Charge0
Average Mass301.342
Monoisotopic Mass301.13141
SMILESCOc1cc2c(cc1O)C(Cc1ccc(O)c(O)c1)NCC2
InChIInChI=1S/C17H19NO4/c1-22-17-8-11-4-5-18-13(12(11)9-16(17)21)6-10-2-3-14(19)15(20)7-10/h2-3,7-9,13,18-21H,4-6H2,1H3
InChIKeyRHMGJTZOFARRHB-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
6-O-methylnorlaudanosoline (CHEBI:15944) has functional parent norlaudanosoline (CHEBI:28770)
6-O-methylnorlaudanosoline (CHEBI:15944) is a benzyltetrahydroisoquinoline (CHEBI:26901)
6-O-methylnorlaudanosoline (CHEBI:15944) is conjugate base of 6-O-methylnorlaudanosolinium (CHEBI:57578)
Incoming Relation(s)
6-O-methylnorlaudanosolinium (CHEBI:57578) is conjugate acid of 6-O-methylnorlaudanosoline (CHEBI:15944)
IUPAC Name 
4-[(7-hydroxy-6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]benzene-1,2-diol
Synonym  Source
6-O-MethylnorlaudanosolineKEGG COMPOUND
Manual XrefsDatabases
C05203KEGG COMPOUND
Registry NumbersSources
Beilstein:3625035Beilstein
CAS:64710-33-4ChemIDplus