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,
InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:31 - (+)-menthone
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ChEBI Ontology
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ChEBI Name
(+)-menthone
ChEBI ID
CHEBI:31
Definition
A menthone that is cyclohexanone substituted by a methyl and an isopropyl group at positions 5 and 2 respectively (the 2
R
,5
S
-stereoisomer).
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C10H18O
Net Charge
0
Average Mass
154.24932
Monoisotopic Mass
154.13577
InChI
InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-9H,4-6H2,1-3H3/t8-,9+/m0/s1
InChIKey
NFLGAXVYCFJBMK-DTWKUNHWSA-N
SMILES
CC(C)[C@H]1CC[C@H](C)CC1=O
Roles Classification
Biological Role
(s):
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
(via
p-menthan-3-one
)
volatile oil component
Any plant metabolite that is found naturally as a component of a volatile oil.
(via
p-menthan-3-one
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
(+)-menthone (
CHEBI:31
)
is a
menthone (
CHEBI:36503
)
(+)-menthone (
CHEBI:31
)
is enantiomer of
(−)-menthone (
CHEBI:15410
)
Incoming
(4
S
,7
R
)-7-isopropyl-4-methyloxepan-2-one (
CHEBI:138383
)
has functional parent
(+)-menthone (
CHEBI:31
)
(−)-menthone (
CHEBI:15410
)
is enantiomer of
(+)-menthone (
CHEBI:31
)
IUPAC Name
(2
R
,5
S
)-5-methyl-2-(propan-2-yl)cyclohexanone
Synonyms
Sources
(+)-Menthone
KEGG COMPOUND
(1
S
,4
R
)-menthone
UniProt
(1
S
,4
R
)-
p
-menthan-3-one
IUPAC
(2
R
,5
S
)-2-isopropyl-5-methylcyclohexanone
IUPAC
Manual Xrefs
Databases
C00010903
KNApSAcK
C11390
KEGG COMPOUND
View more database links
Registry Numbers
Types
Sources
2041367
Reaxys Registry Number
Reaxys
2041367
Beilstein Registry Number
Beilstein
3391-87-5
CAS Registry Number
KEGG COMPOUND
3391-87-5
CAS Registry Number
ChemIDplus
5245020
Beilstein Registry Number
Beilstein
Last Modified
06 September 2017