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CHEBI:82204 - (4R)-7-hydroxy-4-isopropenyl-7-methyloxepan-2-one

ChEBI IDCHEBI:82204
ChEBI Name(4R)-7-hydroxy-4-isopropenyl-7-methyloxepan-2-one
Stars
ASCII Name(4R)-7-hydroxy-4-isopropenyl-7-methyloxepan-2-one
DefinitionA 7-hydroxy-4-isopropenyl-7-methyloxepan-2-one that has R configuration at position 4.
Last Modified5 September 2017
DownloadsMolfile
FormulaC10H16O3
Net Charge0
Average Mass184.235
Monoisotopic Mass184.10994
SMILESC=C(C)[C@@H]1CCC(C)(O)OC(=O)C1
InChIInChI=1S/C10H16O3/c1-7(2)8-4-5-10(3,12)13-9(11)6-8/h8,12H,1,4-6H2,2-3H3/t8-,10?/m1/s1
InChIKeyZZVPZXLETLTSEB-HNHGDDPOSA-N
ChEBI Ontology
Outgoing Relation(s)
(4R)-7-hydroxy-4-isopropenyl-7-methyloxepan-2-one (CHEBI:82204) is a 7-hydroxy-4-isopropenyl-7-methyloxepan-2-one (CHEBI:64274)
Incoming Relation(s)
(3R)-3-isopropenyl-6-oxoheptanoic acid (CHEBI:37287) has functional parent (4R)-7-hydroxy-4-isopropenyl-7-methyloxepan-2-one (CHEBI:82204)
(4R,7R)-7-hydroxy-4-isopropenyl-7-methyloxepan-2-one (CHEBI:138597) is a (4R)-7-hydroxy-4-isopropenyl-7-methyloxepan-2-one (CHEBI:82204)
(4R,7S)-7-hydroxy-4-isopropenyl-7-methyloxepan-2-one (CHEBI:138363) is a (4R)-7-hydroxy-4-isopropenyl-7-methyloxepan-2-one (CHEBI:82204)
IUPAC Name 
(4R)-7-hydroxy-7-methyl-4-(prop-1-en-2-yl)oxepan-2-one
Synonym  Source
(4R)-7-Hydroxy-4-isopropenyl-7-methyloxepan-2-oneKEGG COMPOUND
Manual XrefsDatabases
C19079KEGG COMPOUND
CPD-10059MetaCyc