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Metanicotine

CAT: 0931-T69134-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T69134-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
538-79-4
Target
Others, AChR
Related Pathways
Neuroscience, Others
Bioactivity
Metanicotine is a selective nicotinic agonist with antinociceptive properties.
Smiles
C(=CCCNC)C=1C=CC=NC1
Molecular Formula
C10H14N2
Molecular Weight
162.23
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Rivanicline

Rivanicline (TC-2403, RJR-2403, (E)-metanicotine) is a partial agonist at neuronal nicotinic acetylcholine receptors, binding primarily to the α4β2 subtype. It was originally developed as a potential treatment for Alzheimer's disease for its nootropic effects but has also been found to inhibit the production of Interleukin-8. It has subsequently been developed as a potential anti-inflammatory treatment for ulcerative colitis. Rivanicline also has stimulant and analgesic actions which are thought due to increased noradrenaline release.

CAS Number538-79-4
PubChem CID5310967
IUPAC Name(E)-N-methyl-4-pyridin-3-ylbut-3-en-1-amine
Molecular FormulaC10H14N2
Molecular Weight162.23
XLogP1.1
Topological Polar Surface Area24.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count12
Formal Charge0
Complexity132
SMILES
CNCC/C=C/C1=CN=CC=C1
InChI
InChI=1S/C10H14N2/c1-11-7-3-2-5-10-6-4-8-12-9-10/h2,4-6,8-9,11H,3,7H2,1H3/b5-2+
InChIKey
JUOSGGQXEBBCJB-GORDUTHDSA-N
Chemical Structure
2D Structure
2D structure of Rivanicline
CAS: 538-79-4
CID: 5310967
Formula: C10H14N2
MW: 162.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight162.23
XLogP31.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass162.115698455
Monoisotopic Mass162.115698455
Topological Polar Surface Area24.9 Ų
Heavy Atom Count12
Formal Charge0
Complexity132
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
AAA53879-01Metanicotine
A11545-50Metanicotine 50mg
TRC-M321252-1MGMetanicotine-d3
A11545-25Metanicotine 25mg
A11545-5Metanicotine 5mg
A11545-100Metanicotine 100mg
A11545-10Metanicotine 10mg
BUP01600-01(Z) -Metanicotine 2HCl
MBS5819379(Z)-Metanicotine 2HCl
sc-218833[Methyl-d3]metanicotine

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