CHEBI:64274 - 7-hydroxy-4-isopropenyl-7-methyloxepan-2-one

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name 7-hydroxy-4-isopropenyl-7-methyloxepan-2-one ChEBI ID CHEBI:64274 Definition A terpene lactone that is oxepan-2-one bearing an isopropenyl substituent at position 4 as well as hydroxy and methyl substituents at position 7. Stars This entity has been manually annotated by the ChEBI Team. Submitter Kristian Axelsen Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C10H16O3 Net Charge 0 Average Mass 184.23220 Monoisotopic Mass 184.10994 InChI InChI=1S/C10H16O3/c1-7(2)8-4-5-10(3,12)13-9(11)6-8/h8,12H,1,4-6H2,2-3H3 InChIKey ZZVPZXLETLTSEB-UHFFFAOYSA-N SMILES CC(=C)C1CCC(C)(O)OC(=O)C1 ChEBI Ontology Outgoing 7-hydroxy-4-isopropenyl-7-methyloxepan-2-one (CHEBI:64274) is a ε-lactone (CHEBI:50239) 7-hydroxy-4-isopropenyl-7-methyloxepan-2-one (CHEBI:64274) is a monoterpenoid (CHEBI:25409) 7-hydroxy-4-isopropenyl-7-methyloxepan-2-one (CHEBI:64274) is a terpene lactone (CHEBI:37668) Incoming (4R)-7-hydroxy-4-isopropenyl-7-methyloxepan-2-one (CHEBI:82204) is a 7-hydroxy-4-isopropenyl-7-methyloxepan-2-one (CHEBI:64274) (4S)-7-hydroxy-4-isopropenyl-7-methyloxepan-2-one (CHEBI:82207) is a 7-hydroxy-4-isopropenyl-7-methyloxepan-2-one (CHEBI:64274) IUPAC Name 7-hydroxy-7-methyl-4-(prop-1-en-2-yl)oxepan-2-one Synonym Source 7-hydroxy-4-isopropenyl-7-methyloxepan-2-one UniProt Manual Xref Database 3-Isopropenyl-4H-hexano-lactones MetaCyc View more database links Last Modified 05 September 2017