EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:193127 - (R)-laudanosolinium

ChEBI IDCHEBI:193127
ChEBI Name(R)-laudanosolinium
Stars
ASCII Name(R)-laudanosolinium
DefinitionConjugate acid of (R)-laudanosoline arising from protonation of the isoquinoline nitrogen; major microspecies at pH 7.3.
SubmitterAnne Morgat
DownloadsMolfile
FormulaC17H20NO4
Net Charge+1
Average Mass302.350
Monoisotopic Mass302.13868
SMILESC[NH+]1CCc2cc(O)c(O)cc2[C@H]1Cc1ccc(O)c(O)c1
InChIInChI=1S/C17H19NO4/c1-18-5-4-11-8-16(21)17(22)9-12(11)13(18)6-10-2-3-14(19)15(20)7-10/h2-3,7-9,13,19-22H,4-6H2,1H3/p+1/t13-/m1/s1
InChIKeyVHRSWCTVFBWHKE-CYBMUJFWSA-O
ChEBI Ontology
Outgoing Relation(s)
(R)-laudanosolinium (CHEBI:193127) has functional parent (R)-norlaudanosoline(1+) (CHEBI:193125)
(R)-laudanosolinium (CHEBI:193127) is a ammonium ion derivative (CHEBI:35274)
Synonym  Source
(R)-N-metylnorlaudanosolineSUBMITTER
UniProt Name  Source
(R)-laudanosolineUniProt
Manual XrefsDatabases
CPD-21518MetaCyc
Citations