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> Main
CHEBI:8607 - pseudopelletierine
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ChEBI Name
pseudopelletierine
ChEBI ID
CHEBI:8607
Definition
An azabicycloalkane alkaloid that is 9-azabicyclo[3.3.1]nonane substituted by a methyl group at position 9 and an oxo group at position 3. It is found in pomegranate trees.
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This entity has been manually annotated by the ChEBI Team.
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Read full article at Wikipedia
Formula
C9H15NO
Net Charge
0
Average Mass
153.22150
Monoisotopic Mass
153.11536
InChI
InChI=1S/C9H15NO/c1-10-7-3-2-4-8(10)6-9(11)5-7/h7-8H,2-6H2,1H3/t7-,8+
InChIKey
RHWSKVCZXBAWLZ-OCAPTIKFSA-N
SMILES
CN1[C@H]2CCC[C@@H]1CC(=O)C2
Roles Classification
Chemical Role
(s):
Bronsted base
A molecular entity capable of accepting a hydron from a donor (Br
o
nsted acid).
(via
organic amino compound
)
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.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via
alkaloid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
pseudopelletierine (
CHEBI:8607
)
has role
plant metabolite (
CHEBI:76924
)
pseudopelletierine (
CHEBI:8607
)
is a
alkaloid (
CHEBI:22315
)
pseudopelletierine (
CHEBI:8607
)
is a
azabicycloalkane (
CHEBI:38295
)
pseudopelletierine (
CHEBI:8607
)
is a
cyclic ketone (
CHEBI:3992
)
pseudopelletierine (
CHEBI:8607
)
is a
tertiary amino compound (
CHEBI:50996
)
IUPAC Name
9-methyl-9-azabicyclo[3.3.1]nonan-3-one
Synonyms
Sources
9-Methyl-3-granatanone
ChemIDplus
Granatan-3-one
ChemIDplus
Granatonine
ChemIDplus
N-Methylgranatonine
HMDB
psi-Pelletierine
ChemIDplus
Manual Xrefs
Databases
C00002300
KNApSAcK
C10865
KEGG COMPOUND
HMDB0034580
HMDB
Pseudopelletierine
Wikipedia
View more database links
Registry Numbers
Types
Sources
3298
Reaxys Registry Number
Reaxys
552-70-5
CAS Registry Number
KEGG COMPOUND
552-70-5
CAS Registry Number
ChemIDplus
Citations
Types
Sources
13233087
PubMed citation
Europe PMC
20292490
PubMed citation
Europe PMC
22163834
PubMed citation
Europe PMC
Last Modified
24 February 2016