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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:4632 - diosphenol
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ChEBI Name
diosphenol
ChEBI ID
CHEBI:4632
Definition
A cyclic monoterpene ketone that is cyclohex-2-en-1-one substituted by a hydroxy group at position 2, a methyl group at position 3 and an isopropyl group at position 6.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C10H16O2
Net Charge
0
Average Mass
168.23284
Monoisotopic Mass
168.11503
InChI
InChI=1S/C10H16O2/c1-6(2)8-5-4-7(3)9(11)10(8)12/h6,8,11H,4-5H2,1-3H3
InChIKey
QSIMLPCPCXVYDD-UHFFFAOYSA-N
SMILES
CC(C)C1CCC(C)=C(O)C1=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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
diosphenol (
CHEBI:4632
)
has role
plant metabolite (
CHEBI:76924
)
diosphenol (
CHEBI:4632
)
is a
cyclic monoterpene ketone (
CHEBI:23446
)
diosphenol (
CHEBI:4632
)
is a
enol (
CHEBI:33823
)
IUPAC Name
2-hydroxy-3-methyl-6-(propan-2-yl)cyclohex-2-en-1-one
Synonyms
Sources
2-Hydroxy-6-isopropyl-3-methyl-2-cyclohexen-1-one
NIST Chemistry WebBook
2-Hydroxypiperitone
ChemIDplus
Barosma camphor
NIST Chemistry WebBook
Buccocamphor
NIST Chemistry WebBook
Buchu camphor
NIST Chemistry WebBook
Diosphenol
KEGG COMPOUND
Manual Xrefs
Databases
C00003042
KNApSAcK
C09854
KEGG COMPOUND
View more database links
Registry Numbers
Types
Sources
490-03-9
CAS Registry Number
ChemIDplus
490-03-9
CAS Registry Number
NIST Chemistry WebBook
Citation
Type
Source
23354816
PubMed citation
Europe PMC
Last Modified
12 February 2015