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CHEBI:80089 - Coronafacic acid

Default Structure
ChEBI IDCHEBI:80089
ChEBI NameCoronafacic acid
Stars
DownloadsMolfile
FormulaC12H16O3
Net Charge0
Average Mass208.257
Monoisotopic Mass208.10994
SMILES[H][C@]12C[C@@H](CC)C=C(C(=O)O)[C@@]1([H])CCC2=O
InChIInChI=1S/C12H16O3/c1-2-7-5-9-8(3-4-11(9)13)10(6-7)12(14)15/h6-9H,2-5H2,1H3,(H,14,15)/t7-,8+,9+/m1/s1
InChIKeyONMAUQRMJXNSCG-VGMNWLOBSA-N
ChEBI Ontology
Outgoing Relation(s)
Coronafacic acid (CHEBI:80089) is a ketone (CHEBI:17087)
Manual XrefsDatabases
C15765KEGG COMPOUND
Registry NumbersSources
CAS:62251-98-3KEGG COMPOUND