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(Q82328240)
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AGN-PC-0NIHB1
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
pyrrolidine alkaloid
0 references
piperidine alkaloids
0 references
mass
224.188863388
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₂₄N₂O
0 references
canonical SMILES
O=C(CC1NCCCC1)CC2N(C)CCC2
0 references
found in taxon
Withania somnifera
1 reference
stated in
Alkaloid-Bearing Plants and Their Contained Alkaloids. 1957-1968
Identifiers
InChI
InChI=1S/C13H24N2O/c1-15-8-4-6-12(15)10-13(16)9-11-5-2-3-7-14-11/h11-12,14H,2-10H2,1H3
0 references
InChIKey
FONWOVFPQFNSTJ-UHFFFAOYSA-N
0 references
CAS Registry Number
2505-55-7
0 references
PubChem CID
12306778
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
FONWOVFPQFNSTJ-UHFFFAOYSA-N
UniChem compound ID
42278878
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60486785
1 reference
matched by identifier from
InChIKey
InChIKey
FONWOVFPQFNSTJ-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID60437595
0 references
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