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CHEBI:38818 - N-methylcoclaurine

ChEBI IDCHEBI:38818
ChEBI NameN-methylcoclaurine
Stars
ASCII NameN-methylcoclaurine
Last Modified4 May 2018
DownloadsMolfile
FormulaC18H21NO3
Net Charge0
Average Mass299.370
Monoisotopic Mass299.15214
SMILESCOc1cc2c(cc1O)C(Cc1ccc(O)cc1)N(C)CC2
InChIInChI=1S/C18H21NO3/c1-19-8-7-13-10-18(22-2)17(21)11-15(13)16(19)9-12-3-5-14(20)6-4-12/h3-6,10-11,16,20-21H,7-9H2,1-2H3
InChIKeyBOKVLBSSPUTWLV-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-methylcoclaurine (CHEBI:38818) has functional parent coclaurine (CHEBI:23347)
N-methylcoclaurine (CHEBI:38818) is a benzyltetrahydroisoquinoline (CHEBI:26901)
Incoming Relation(s)
(R)-N-methylcoclaurine (CHEBI:16387) is a N-methylcoclaurine (CHEBI:38818)
(R)-N-methylcoclaurinium (CHEBI:57755) is a N-methylcoclaurine (CHEBI:38818)
(S)-N-methylcoclaurine (CHEBI:17041) is a N-methylcoclaurine (CHEBI:38818)