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CHEBI:231628 - (RS)-isococlaurinium

ChEBI IDCHEBI:231628
ChEBI Name(RS)-isococlaurinium
Stars
ASCII Name(RS)-isococlaurinium
DefinitionMajor species at pH 7.3.
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC17H20NO3
Net Charge+1
Average Mass286.351
Monoisotopic Mass286.14377
SMILESCOc1cc2c(cc1O)CC[NH2+]C2Cc1ccc(O)cc1
InChIInChI=1S/C17H19NO3/c1-21-17-10-14-12(9-16(17)20)6-7-18-15(14)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3/p+1
InChIKeyHDQFMSLXNCGZDJ-UHFFFAOYSA-O
ChEBI Ontology
Outgoing Relation(s)
(RS)-isococlaurinium (CHEBI:231628) is a ammonium ion derivative (CHEBI:35274)
UniProt Name  Source
isococlaurineUniProt
Citations