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CHEBI:8900 - Rotundifolone

ChEBI IDCHEBI:8900
ChEBI NameRotundifolone
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC10H14O2
Net Charge0
Average Mass166.220
Monoisotopic Mass166.09938
SMILES[H][C@]12O[C@@]1(C)CCC(=C(C)C)C2=O
InChIInChI=1S/C10H14O2/c1-6(2)7-4-5-10(3)9(12-10)8(7)11/h9H,4-5H2,1-3H3/t9-,10+/m1/s1
InChIKeyAKASWINDKIEEBO-ZJUUUORDSA-N
ChEBI Ontology
Outgoing Relation(s)
Rotundifolone (CHEBI:8900) is a oxacycle (CHEBI:38104)
Synonyms  Source
RotundifoloneKEGG COMPOUND
LippioneKEGG COMPOUND
Manual XrefsDatabases
C09896KEGG COMPOUND
C00003058KNApSAcK
Registry NumbersSources
CAS:3564-96-3KEGG COMPOUND