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CHEBI:231629 - (RS)-7-O-methylcoclaurinium

ChEBI IDCHEBI:231629
ChEBI Name(RS)-7-O-methylcoclaurinium
Stars
ASCII Name(RS)-7-O-methylcoclaurinium
DefinitionMajor species at pH 7.3.
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC18H22NO3
Net Charge+1
Average Mass300.378
Monoisotopic Mass300.15942
SMILESCOc1cc2c(cc1OC)C(Cc1ccc(O)cc1)[NH2+]CC2
InChIInChI=1S/C18H21NO3/c1-21-17-10-13-7-8-19-16(15(13)11-18(17)22-2)9-12-3-5-14(20)6-4-12/h3-6,10-11,16,19-20H,7-9H2,1-2H3/p+1
InChIKeyNKBBUUNAVOMVER-UHFFFAOYSA-O
ChEBI Ontology
Outgoing Relation(s)
(RS)-7-O-methylcoclaurinium (CHEBI:231629) is a ammonium ion derivative (CHEBI:35274)
UniProt Name  Source
7-O-methylcoclaurineUniProt
Citations