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CHEBI:6634 - Magellanine

ChEBI IDCHEBI:6634
ChEBI NameMagellanine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC17H25NO2
Net Charge0
Average Mass275.392
Monoisotopic Mass275.18853
SMILES[H][C@@]12CN(C)CC[C@]1([H])[C@@]1([H])[C@@H](O)C[C@]3([H])CC(C)=CC(=O)[C@@]31C2
InChIInChI=1S/C17H25NO2/c1-10-5-12-7-14(19)16-13-3-4-18(2)9-11(13)8-17(12,16)15(20)6-10/h6,11-14,16,19H,3-5,7-9H2,1-2H3/t11-,12+,13+,14+,16+,17-/m1/s1
InChIKeyADRPSBGLUHNVOU-INSRFAMQSA-N
ChEBI Ontology
Outgoing Relation(s)
Magellanine (CHEBI:6634) is a piperidines (CHEBI:26151)
Synonym  Source
MagellanineKEGG COMPOUND
Manual XrefsDatabases
C09886KEGG COMPOUND
C00001949KNApSAcK
Registry NumbersSources
CAS:61273-75-4KEGG COMPOUND