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CHEBI:234345 - hyoscyamine aldehyde(1+)

ChEBI IDCHEBI:234345
ChEBI Namehyoscyamine aldehyde(1+)
Stars
DefinitionMajor species at pH 7.3.
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC17H22NO3
Net Charge+1
Average Mass288.367
Monoisotopic Mass288.15942
SMILESC[NH+]1[C@@H]2CC[C@H]1C[C@@H](OC(=O)[C@H](C=O)c1ccccc1)C2
InChIInChI=1S/C17H21NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,11,13-16H,7-10H2,1H3/p+1/t13-,14+,15+,16-/m1/s1
InChIKeyRMBZQGMKGCCRKF-FXUDXRNXSA-O
ChEBI Ontology
Outgoing Relation(s)
hyoscyamine aldehyde(1+) (CHEBI:234345) is a ammonium ion derivative (CHEBI:35274)
UniProt Name  Source
hyoscyamine aldehydeUniProt
Manual XrefsDatabases
CPD-27791MetaCyc
Citations