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CHEBI:2502 - Affinine

ChEBI IDCHEBI:2502
ChEBI NameAffinine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC20H24N2O2
Net Charge0
Average Mass324.424
Monoisotopic Mass324.18378
SMILESC/C=C1/CN(C)[C@@H]2Cc3c(nc4ccccc34)C(=O)C[C@H]1C2CO
InChIInChI=1S/C20H24N2O2/c1-3-12-10-22(2)18-8-15-13-6-4-5-7-17(13)21-20(15)19(24)9-14(12)16(18)11-23/h3-7,14,16,18,21,23H,8-11H2,1-2H3/b12-3-/t14-,16?,18-/m1/s1
InChIKeyPXFBZOLANLWPMH-SMLHJDAJSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Affinine (CHEBI:2502) is a alkaloid (CHEBI:22315)
Synonym  Source
AffinineKEGG COMPOUND
Manual XrefsDatabases
C00001675KNApSAcK
C09021KEGG COMPOUND
Registry NumbersSources
CAS:2134-82-9KEGG COMPOUND