Methylnaloxonium

Details

Stereochemistry	EPIMERIC
Molecular Formula	C20H24NO4
Molecular Weight	342.4089
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 5
E/Z Centers	0
Charge	1

SHOW SMILES / InChI

Structure Search

SMILES

C[N+]1(CC=C)CC[C@]23[C@H]4OC5=C(O)C=CC(C[C@@H]1[C@]2(O)CCC4=O)=C35

InChI

InChIKey=PCSQOABIHJXZMR-MGQKVWQSSA-O

InChI=1S/C20H23NO4/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/p+1/t15-,18+,19+,20-,21?/m1/s1

HIDE SMILES / InChI

Molecular Formula	C20H24NO4
Molecular Weight	342.4089
Charge	1
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	4 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 07:59:38 GMT 2025` Edited by `admin` on `Wed Apr 02 07:59:38 GMT 2025`
Record UNII	R4755TU8QX
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

Methylnaloxone

Preferred Name

English

Methylnaloxonium

Common Name

English

(1S,5R,13R,17S)-10,17-dihydroxy-4-methyl-14-oxo-4-(prop-2-en-1-yl)-12-oxa-4-azapentacyclo[9.6.1.0{1,13}.0{5,17}.0{7,18}]octadeca-7,9,11(18)-trien-4-ium

Systematic Name

English

N-Methylnaloxone

Common Name

English

(5?)-4,5-Epoxy-3,14-dihydroxy-17-methyl-6-oxo-17-(2-propenyl)morphinanium

Systematic Name

English

Morphinanium, 4,5-epoxy-3,14-dihydroxy-17-methyl-6-oxo-17-(2-propenyl)-, (5?)-

Systematic Name

English

Code System Code Type Description

CAS

73232-50-5

Created by admin on Wed Apr 02 07:59:38 GMT 2025 , Edited by admin on Wed Apr 02 07:59:38 GMT 2025

PRIMARY

FDA UNII

R4755TU8QX

Created by admin on Wed Apr 02 07:59:38 GMT 2025 , Edited by admin on Wed Apr 02 07:59:38 GMT 2025

PRIMARY

EPA CompTox

DTXSID90993977

Created by admin on Wed Apr 02 07:59:38 GMT 2025 , Edited by admin on Wed Apr 02 07:59:38 GMT 2025

PRIMARY

PUBCHEM

5486183

Created by admin on Wed Apr 02 07:59:38 GMT 2025 , Edited by admin on Wed Apr 02 07:59:38 GMT 2025

PRIMARY

Related Record Type Details


					R4755TU8QX

Methylnaloxonium

IONIC MOIETY

Amount: