Scopine (hydrochloride)

CAT: 0804-HY-B0459A-01Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0804-HY-B0459A-01Size:5 mg

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Description

Scopine hydrochloride is a metabolite of Scopolamine and brain-targeting compound. Scopine hydrochloride significantly increases the brain exposure of Chlorambucil (HY-13593) and enhances its anti-glioma activity. Scopine hydrochloride can be used in targeted therapy research for brain gliomas[1].

CAS Number

85700-55-6

Product Name Alternative

6,7-Epoxytropine hydrochloride

UNSPSC

12352005

Hazard Statement

H302, H315, H319, H335

Target

Drug Metabolite

Type

Reference compound

Related Pathways

Metabolic Enzyme/Protease

Applications

Neuroscience-Neuromodulation

Field of Research

Cancer; Neurological Disease

Assay Protocol

https://www.medchemexpress.com/Scopine-hydrochloride.html

Purity

99.69

Solubility

DMSO : 25 mg/mL (ultrasonic) |H2O : ≥ 100 mg/mL

Smiles

O[C@H]1C[C@H]2[C@@H]3O[C@@H]3[C@H](N2C)C1.[H]Cl

Molecular Formula

C8H14ClNO2

Molecular Weight

191.66

Precautions

H302, H315, H319, H335

References & Citations

[1]Wang X, et al. Scopine as a novel brain-targeting moiety enhances the brain uptake of chlorambucil. Bioconjug Chem. 2014 Nov 19;25 (11) :2046-54.

Shipping Conditions

Room Temperature

Storage Conditions

4°C (Powder, sealed storage, away from moisture)

Scientific Category

Reference compound1

Clinical Information

No Development Reported

Isoform

α adrenergic receptor

Citation 01

Anal Bioanal Chem. 2025 Jun;417 (14) :3169-3176.|Molecules. 2025 Oct 23;30 (21) :4170.

Chemical Information

Scopine hydrochloride

CAS Number	85700-55-6
PubChem CID	24720972
IUPAC Name	(1R,2R,4S,5S)-9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-7-ol;hydrochloride
Molecular Formula	C8H14ClNO2
Molecular Weight	191.65
Topological Polar Surface Area	36
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Heavy Atom Count	12
Formal Charge	0
Complexity	179

SMILES

CN1[C@@H]2CC(C[C@H]1[C@H]3[C@@H]2O3)O.Cl

InChI

InChI=1S/C8H13NO2.ClH/c1-9-5-2-4(10)3-6(9)8-7(5)11-8;/h4-8,10H,2-3H2,1H3;1H/t4?,5-,6+,7-,8+;

InChIKey

BBBRAOXIMQHVCR-QYRWGYAXSA-N

Chemical Structure

2D Structure

CAS: 85700-55-6

CID: 24720972

Formula: C8H14ClNO2

MW: 191.65

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	191.65
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	191.0713064
Monoisotopic Mass	191.0713064
Topological Polar Surface Area	36 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	179
Isotope Atom Count	0
Defined Atom Stereocenter Count	4
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

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289119-01	Scopine hydrochloride
B1364-S	Scopine

Scopine (hydrochloride)

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