CHEBI:6738 - Melochinone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Melochinone
ChEBI ID CHEBI:6738
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C22H21NO2
Net Charge 0
Average Mass 331.408
Monoisotopic Mass 331.15723
InChI InChI=1S/C22H21NO2/c1-14-22(25-2)21(24)20-18-11-7-6-10-16(15-8-4-3-5-9-15)17(18)12-13-19(20)23-14/h3-5,8-10,12-13H,6-7,11H2,1-2H3,(H,23,24)
InChIKey DNBWHNVLJOVDJI-UHFFFAOYSA-N
SMILES COc1c(C)[nH]c2ccc3c(CCCC=C3c3ccccc3)c2c1=O
ChEBI Ontology
Outgoing Melochinone (CHEBI:6738) is a quinolines (CHEBI:26513)
Synonym Source
Melochinone KEGG COMPOUND
Manual Xrefs Databases
C00002188 KNApSAcK
C10727 KEGG COMPOUND
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Registry Number Type Source
57609-68-4 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014