CHEBI:36492 - (+)-isomenthone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (+)-isomenthone
ChEBI ID CHEBI:36492
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:18459, CHEBI:29453
Supplier Information
Download Molfile XML SDF
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-/m1/s1
InChIKey NFLGAXVYCFJBMK-RKDXNWHRSA-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 (+)-isomenthone (CHEBI:36492) is a isomenthone (CHEBI:36493)
(+)-isomenthone (CHEBI:36492) is enantiomer of (−)-isomenthone (CHEBI:36496)
Incoming (−)-isomenthone (CHEBI:36496) is enantiomer of (+)-isomenthone (CHEBI:36492)
IUPAC Name
(2R,5R)-5-methyl-2-(propan-2-yl)cyclohexanone
Synonyms Sources
(+)-Isomenthone KEGG COMPOUND
(1R,4R)-p-menthan-3-one IUPAC
(2R,5R)-2-isopropyl-5-methylcyclohexanone IUPAC
(2R,5R)-isomenthone UniProt
(2R-cis)-5-methyl-2-(1-methylethyl)cyclohexanone NIST Chemistry WebBook
d-isomenthone NIST Chemistry WebBook
Manual Xrefs Databases
C00010902 KNApSAcK
C11952 KEGG COMPOUND
LMPR0102090044 LIPID MAPS
View more database links
Registry Numbers Types Sources
1196-31-2 CAS Registry Number KEGG COMPOUND
1196-31-2 CAS Registry Number NIST Chemistry WebBook
1196-31-2 CAS Registry Number ChemIDplus
2041366 Beilstein Registry Number Beilstein
5245019 Beilstein Registry Number Beilstein
Last Modified
27 July 2015