CHEBI:1995 - 5,6-Dehydrokawain

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5,6-Dehydrokawain
ChEBI ID CHEBI:1995
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C14H12O3
Net Charge 0
Average Mass 228.244
Monoisotopic Mass 228.079
InChI InChI=1S/C14H12O3/c1-16-13-9-12(17-14(15)10-13)8-7-11-5-3-2-4-6-11/h2-10H,1H3/b8-7+
InChIKey DKKJNZYHGRUXBS-BQYQJAHWSA-N
SMILES COc1cc(\C=C\c2ccccc2)oc(=O)c1
ChEBI Ontology
Outgoing 5,6-Dehydrokawain (CHEBI:1995) is a 2-pyranones (CHEBI:75885)
5,6-Dehydrokawain (CHEBI:1995) is a aromatic ether (CHEBI:35618)
Synonym Source
5,6-Dehydrokawain KEGG COMPOUND
Manual Xrefs Databases
C00002987 KNApSAcK
C09925 KEGG COMPOUND
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Registry Number Type Source
1952-41-6 CAS Registry Number KEGG COMPOUND
Last Modified
08 January 2016