CHEBI:80930 - Costatone

ChEBI IDCHEBI:80930
ChEBI NameCostatone
Stars
DownloadsMolfile
FormulaC10H12Br2Cl2O2
Net Charge0
Average Mass394.918
Monoisotopic Mass391.85811
SMILESCC1=C(Cl)C[C@@H](/C(C)=C\Cl)O[C@@]1(O)C(Br)Br
InChIInChI=1S/C10H12Br2Cl2O2/c1-5(4-13)8-3-7(14)6(2)10(15,16-8)9(11)12/h4,8-9,15H,3H2,1-2H3/b5-4-/t8-,10+/m0/s1
InChIKeyCVIPXLIMSIYMFK-BJLGHUSZSA-N
ChEBI Ontology
Outgoing Relation(s)
Costatone (CHEBI:80930) is a pyrans (CHEBI:26407)
Manual XrefsDatabases
C00010402KNApSAcK
C17104KEGG COMPOUND
Registry NumbersSources
CAS:63023-59-6KEGG COMPOUND