Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
CHEBI:48933 - piperitone
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
piperitone
ChEBI ID
CHEBI:48933
Definition
A
p
-menthane monoterpenoid that is cyclohex-2-en-1-one substituted by a methyl group at position 3 and an isopropyl group at position 6.
Stars
This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
more structures >>
Molfile
Wikipedia
License
Read full article at Wikipedia
Formula
C10H16O
Net Charge
0
Average Mass
152.23340
Monoisotopic Mass
152.12012
InChI
InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)6-10(9)11/h6-7,9H,4-5H2,1-3H3
InChIKey
YSTPAHQEHQSRJD-UHFFFAOYSA-N
SMILES
CC(C)C1CCC(C)=CC1=O
Roles Classification
Biological Role
(s):
volatile oil component
Any plant metabolite that is found naturally as a component of a volatile oil.
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
piperitone (
CHEBI:48933
)
has role
plant metabolite (
CHEBI:76924
)
piperitone (
CHEBI:48933
)
has role
volatile oil component (
CHEBI:27311
)
piperitone (
CHEBI:48933
)
is a
p
-menthane monoterpenoid (
CHEBI:25186
)
piperitone (
CHEBI:48933
)
is a
cyclic terpene ketone (
CHEBI:36130
)
Incoming
(−)-piperitone (
CHEBI:48934
)
is a
piperitone (
CHEBI:48933
)
(+)-piperitone (
CHEBI:41
)
is a
piperitone (
CHEBI:48933
)
IUPAC Name
3-methyl-6-(propan-2-yl)cyclohex-2-en-1-one
Synonyms
Sources
3-Carvomenthenone
ChemIDplus
3-methyl-6-(1-methylethyl)-2-cyclohexen-1-one
ChemIDplus
6-Isopropyl-3-methylcyclohex-2-enone
ChemIDplus
p-Menth-1-en-3-one
ChemIDplus
Manual Xrefs
Databases
HMDB0034975
HMDB
Piperitone
Wikipedia
US2972632
Patent
View more database links
Registry Numbers
Types
Sources
1907772
Reaxys Registry Number
Reaxys
1907772
Beilstein Registry Number
Beilstein
89-81-6
CAS Registry Number
ChemIDplus
Citations
Types
Sources
17987504
PubMed citation
Europe PMC
18106118
PubMed citation
Europe PMC
20872669
PubMed citation
Europe PMC
23477664
PubMed citation
Europe PMC
23564737
PubMed citation
Europe PMC
26735409
PubMed citation
Europe PMC
27041315
PubMed citation
Europe PMC
29543527
PubMed citation
Europe PMC
Last Modified
13 June 2018