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Tigloidin

CAT: 0013-GTR19204626-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19204626-02Size:50 mg
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Description
Tigloidin is a structural analog of atropine that exhibits anticholinergic properties. It is utilized in pharmacological research to study muscarinic receptor function and cholinergic pathways in both in vitro binding assays and in vivo experimental models.
CAS Number
495-83-0
Field of Research
Neuroscience
Smiles
C\C=C (/C) C (=O) O[C@H]1C[C@@H]2CC[C@H] (C1) N2C
Molecular Formula
C13H21NO2
Molecular Weight
223.31
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Tropigline

Tigloidin has been reported in Brugmansia arborea, Datura inoxia, and other organisms with data available.

CAS Number495-83-0
PubChem CID12444363
IUPAC Name[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] (E)-2-methylbut-2-enoate
Molecular FormulaC13H21NO2
Molecular Weight223.31
XLogP2.5
Topological Polar Surface Area29.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count16
Formal Charge0
Complexity297
SMILES
C/C=C(\C)/C(=O)OC1C[C@H]2CC[C@@H](C1)N2C
InChI
InChI=1S/C13H21NO2/c1-4-9(2)13(15)16-12-7-10-5-6-11(8-12)14(10)3/h4,10-12H,5-8H2,1-3H3/b9-4+/t10-,11+,12?
InChIKey
UVHGSMZRSVGWDJ-ZCFDAEMWSA-N
Chemical Structure
2D Structure
2D structure of Tropigline
CAS: 495-83-0
CID: 12444363
Formula: C13H21NO2
MW: 223.31
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight223.31
XLogP32.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass223.157228913
Monoisotopic Mass223.157228913
Topological Polar Surface Area29.5 Ų
Heavy Atom Count16
Formal Charge0
Complexity297
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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