CHEBI:6508 - Lobelanine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Lobelanine
ChEBI ID CHEBI:6508
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C22H25NO2
Net Charge 0
Average Mass 335.440
Monoisotopic Mass 335.189
InChI InChI=1S/C22H25NO2/c1-23-19(15-21(24)17-9-4-2-5-10-17)13-8-14-20(23)16-22(25)18-11-6-3-7-12-18/h2-7,9-12,19-20H,8,13-16H2,1H3/t19-,20+
InChIKey IDEMKXUAULKYJV-BGYRXZFFSA-N
SMILES CN1[C@@H](CC(=O)c2ccccc2)CCC[C@H]1CC(=O)c1ccccc1
ChEBI Ontology
Outgoing Lobelanine (CHEBI:6508) is a acetophenones (CHEBI:22187)
Synonym Source
Lobelanine KEGG COMPOUND
Manual Xrefs Databases
C00002052 KNApSAcK
C10157 KEGG COMPOUND
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Registry Number Type Source
579-21-5 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014