CHEBI:8900 - Rotundifolone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Rotundifolone
ChEBI ID CHEBI:8900
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C10H14O2
Net Charge 0
Average Mass 166.217
Monoisotopic Mass 166.09938
InChI InChI=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
InChIKey AKASWINDKIEEBO-ZJUUUORDSA-N
SMILES CC(C)=C1CC[C@]2(C)O[C@@H]2C1=O
ChEBI Ontology
Outgoing Rotundifolone (CHEBI:8900) is a oxacycle (CHEBI:38104)
Synonyms Sources
Lippione KEGG COMPOUND
Rotundifolone KEGG COMPOUND
Manual Xrefs Databases
C00003058 KNApSAcK
C09896 KEGG COMPOUND
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Registry Number Type Source
3564-96-3 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014