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Cyclanoline (chloride)

CAT: 0804-HY-120692-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-120692-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Cyclanoline (chloride) shows cholinesterase inhibitory activity[1].
CAS Number
17472-50-3
UNSPSC
12352005
Target
Cholinesterase (ChE)
Type
Natural Products
Related Pathways
Neuronal Signaling
Applications
Neuroscience-Neuromodulation
Field of Research
Neurological Disease
Assay Protocol
https://www.medchemexpress.com/cyclanoline-chloride.html
Purity
96.27
Solubility
DMSO : 100 mg/mL (ultrasonic)
Smiles
C[N@@+]12CCC3=CC(OC)=C(O)C=C3[C@]1([H])CC4=CC=C(OC)C(O)=C4C2.[Cl-]
Molecular Formula
C20H24ClNO4
Molecular Weight
377.86
References & Citations
[1]Kong XP, et al. The Cholinesterase Inhibitory Properties of Stephaniae Tetrandrae Radix. Molecules. 2020;25 (24) :5914. Published 2020 Dec 14.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

Cyclanoline chloride
CAS Number17472-50-3
PubChem CID28564
IUPAC Name3,10-dimethoxy-7-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium-2,9-diol chloride
Molecular FormulaC20H24ClNO4
Molecular Weight377.9
Topological Polar Surface Area58.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count26
Formal Charge0
Complexity488
SMILES
C[N+]12CCC3=CC(=C(C=C3C1CC4=C(C2)C(=C(C=C4)OC)O)O)OC.[Cl-]
InChI
InChI=1S/C20H23NO4.ClH/c1-21-7-6-13-9-19(25-3)17(22)10-14(13)16(21)8-12-4-5-18(24-2)20(23)15(12)11-21;/h4-5,9-10,16H,6-8,11H2,1-3H3,(H-,22,23);1H
InChIKey
RXPKBYHISSKVLV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Cyclanoline chloride
CAS: 17472-50-3
CID: 28564
Formula: C20H24ClNO4
MW: 377.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight377.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass377.1393859
Monoisotopic Mass377.1393859
Topological Polar Surface Area58.9 Ų
Heavy Atom Count26
Formal Charge0
Complexity488
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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