Naloxone methiodide

CAT: 0804-HY-137279Size: 1 mgDry Ice: NoHazardous: No

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CAT#:0804-HY-137279Size:1 mg

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Description

Naloxone methiodide is a peripherally restricted, nonselective, and competitive opioid receptor antagonist. Naloxone methiodide does not penetrate the blood-brain barrier[1][2].

CAS Number

93302-47-7

UNSPSC

12352005

Hazard Statement

H315, H319, H335

Target

Opioid Receptor

Type

Reference compound

Related Pathways

GPCR/G Protein; Neuronal Signaling

Applications

COVID-19-immunoregulation

Field of Research

Inflammation/Immunology

Assay Protocol

https://www.medchemexpress.com/naloxone-methiodide.html

Purity

99.7

Solubility

DMSO : 250 mg/mL (ultrasonic) |H2O : 25 mg/mL (ultrasonic)

Smiles

O[C@@]1(CCC2=O)[C@@]([C@@]2([H])OC3=C4O)(CC5)C3=C(C=C4)C[C@H]1[N@@+]5(C)CC=C.[I-]

Molecular Formula

C20H24INO4

Molecular Weight

469.31

Precautions

H315, H319, H335

References & Citations

[1]Basso L, et al. TRPV1 promotes opioid analgesia during inflammation. Sci Signal. 2019;12 (575) :eaav0711. Published 2019 Apr 2. |[2]Basso L, et al. Endogenous control of inflammatory visceral pain by T cell-derived opioids in IL-10-deficient mice. Neurogastroenterol Motil. 2020;32 (2) :e13743.

Shipping Conditions

Room Temperature

Storage Conditions

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

Scientific Category

Reference compound1

Clinical Information

No Development Reported

Chemical Information

Naloxone Methiodide

CAS Number	93302-47-7
PubChem CID	16219719
IUPAC Name	(4R,4aS,7aR,12bS)-4a,9-dihydroxy-3-methyl-3-prop-2-enyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-3-ium-7-one iodide
Molecular Formula	C20H24INO4
Molecular Weight	469.3
Topological Polar Surface Area	66.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Heavy Atom Count	26
Formal Charge	0
Complexity	637

SMILES

C[N+]1(CC[C@]23[C@@H]4C(=O)CC[C@]2([C@H]1CC5=C3C(=C(C=C5)O)O4)O)CC=C.[I-]

InChI

InChI=1S/C20H23NO4.HI/c1-3-9-21(2)10-8-19-16-12-4-5-13(22)17(16)25-18(19)14(23)6-7-20(19,24)15(21)11-12;/h3-5,15,18,24H,1,6-11H2,2H3;1H/t15-,18+,19+,20-,21?;/m1./s1

InChIKey

ICONPJDAXITIPI-UXYWFNEESA-N

Chemical Structure

2D Structure

CAS: 93302-47-7

CID: 16219719

Formula: C20H24INO4

MW: 469.3

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	469.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Exact Mass	469.07501
Monoisotopic Mass	469.07501
Topological Polar Surface Area	66.8 Å²
Heavy Atom Count	26
Formal Charge	0
Complexity	637
Isotope Atom Count	0
Defined Atom Stereocenter Count	4
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

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