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CHEBI:82007 - Chalcolactone

ChEBI IDCHEBI:82007
ChEBI NameChalcolactone
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DownloadsMolfile
FormulaC20H30O5
Net Charge0
Average Mass350.455
Monoisotopic Mass350.20932
SMILESC[C@@H]1C[C@H](C)[C@H](O)[C@@H](C)C(=O)CC(=O)O[C@H](C)[C@@H](C)/C=C/C=C/C1=O
InChIInChI=1S/C20H30O5/c1-12-8-6-7-9-17(21)13(2)10-14(3)20(24)15(4)18(22)11-19(23)25-16(12)5/h6-9,12-16,20,24H,10-11H2,1-5H3/b8-6+,9-7+/t12-,13+,14-,15-,16+,20-/m0/s1
InChIKeyLCZVAZIKJSPLAY-GLVZILGKSA-N
ChEBI Ontology
Outgoing Relation(s)
Chalcolactone (CHEBI:82007) is a macrolide (CHEBI:25106)
Manual XrefsDatabases
C18848KEGG COMPOUND