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ChEBI
> Main
CHEBI:31170 -
O
-acetyltropine
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ChEBI Name
O
-acetyltropine
ChEBI ID
CHEBI:31170
ChEBI ASCII Name
O-acetyltropine
Definition
An
O
-acyltropine in which the acyl group is acetyl.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C10H17NO2
Net Charge
0
Average Mass
183.24750
Monoisotopic Mass
183.12593
InChI
InChI=1S/C10H17NO2/c1-7(12)13-10-5-8-3-4-9(6-10)11(8)2/h8-10H,3-6H2,1-2H3/t8-,9+,10+
InChIKey
MDIDMOWWLBGYPG-MYJAWHEDSA-N
SMILES
CN1[C@H]2CC[C@@H]1C[C@@H](C2)OC(C)=O
Metabolite of Species
Details
Mus musculus
(NCBI:txid10090)
Source: BioModels - MODEL1507180067 See:
PubMed
Roles Classification
Biological Role
(s):
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (
Mus musculus
).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
O
-acetyltropine (
CHEBI:31170
)
has role
mouse metabolite (
CHEBI:75771
)
O
-acetyltropine (
CHEBI:31170
)
is a
O
-acyltropine (
CHEBI:52656
)
IUPAC Name
(3-
endo
)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl acetate
Synonyms
Sources
3-Acetyltropine
KEGG COMPOUND
Acetyltropine
KEGG COMPOUND
endo-8-methyl-8-azabicyclo[3.2.1]octan-3-ol acetate (ester)
NIST Chemistry WebBook
Manual Xref
Database
C00025551
KNApSAcK
View more database links
Registry Numbers
Types
Sources
3423-27-6
CAS Registry Number
ChemIDplus
3423-27-6
CAS Registry Number
NIST Chemistry WebBook
Last Modified
27 January 2016