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CHEBI:80838 - Isokobusone

ChEBI IDCHEBI:80838
ChEBI NameIsokobusone
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DownloadsMolfile
FormulaC14H22O2
Net Charge0
Average Mass222.328
Monoisotopic Mass222.16198
SMILES[H][C@@]12CCC(=C)[C@@H](O)CCC(=O)[C@@]1([H])CC2(C)C
InChIInChI=1S/C14H22O2/c1-9-4-5-11-10(8-14(11,2)3)13(16)7-6-12(9)15/h10-12,15H,1,4-8H2,2-3H3/t10-,11+,12-/m0/s1
InChIKeyBSFUDCIRZBAPDS-TUAOUCFPSA-N
ChEBI Ontology
Outgoing Relation(s)
Isokobusone (CHEBI:80838) is a organic hydroxy compound (CHEBI:33822)
Manual XrefsDatabases
C16977KEGG COMPOUND