BETACETYLMETHADOL

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H31NO2
Molecular Weight	353.4977
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of BETACETYLMETHADOL

Structure Search

SMILES

CC[C@H](OC(C)=O)C(C[C@@H](C)N(C)C)(C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChIKey=XBMIVRRWGCYBTQ-GCJKJVERSA-N

InChI=1S/C23H31NO2/c1-6-22(26-19(3)25)23(17-18(2)24(4)5,20-13-9-7-10-14-20)21-15-11-8-12-16-21/h7-16,18,22H,6,17H2,1-5H3/t18-,22+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C23H31NO2
Molecular Weight	353.4977
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Description
Sources: https://books.google.ru/books?id=4yaGePenGKgC&pg=PA117&lpg=PA117&dq=BETACETYLMETHADOL&source=bl&ots=vFLh0DybAq&sig=ACfU3U2hoYD9TZWelQ7Z5aWtpu3t0iPvFQ&hl=ru&sa=X&ved=2ahUKEwiq8_6Z-IfiAhWk5aYKHb33CVs4ChDoATACegQICRAB#v=onepage&q=BETACETYLMETHADOL&f=false

Betacetylmethadol is a synthetic narcotic analgesic under international control according to the UN Single Convention 1961.

Approval Year

PubMed

PubMed

Title	Date	PubMed
Carbon-13 nuclear magnetic resonance study of the alpha- and beta- isomers of methadol and acetylmethadol hydrochlorides.	1978	101886

Substance Class	Chemical Created by `admin` on `Sat Dec 16 17:45:12 GMT 2023` Edited by `admin` on `Sat Dec 16 17:45:12 GMT 2023`
Record UNII	905GLN509G
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

BETACETYLMETHADOL

Official Name

English

(3S,6R)-3-ACETOXY-6-DIMETHYLAMINO-4,4-DIPHENYLHEPTANE

Systematic Name

English

ACSCN-9607

Common Name

English

IDS-NB-003

Code

English

BENZENEETHANOL, .BETA.-((2R)-2-(DIMETHYLAMINO)PROPYL)-.ALPHA.-ETHYL-.BETA.-PHENYL-, 1-ACETATE, (.ALPHA.S)-

Systematic Name

English

.BETA.-3-ACETOXY-6-DIMETHYLAMINO-4,4-DIPHENYLHEPTANE

Systematic Name

English

betacetylmethadol [INN]

Common Name

English

Classification Tree Code System Code

DEA NO.

9607

Created by admin on Sat Dec 16 17:45:13 GMT 2023 , Edited by admin on Sat Dec 16 17:45:13 GMT 2023

NCI_THESAURUS

C67413

Created by admin on Sat Dec 16 17:45:13 GMT 2023 , Edited by admin on Sat Dec 16 17:45:13 GMT 2023

Code System Code Type Description

EVMPD

SUB05792MIG

Created by admin on Sat Dec 16 17:45:13 GMT 2023 , Edited by admin on Sat Dec 16 17:45:13 GMT 2023

PRIMARY

CAS

17199-59-6

Created by admin on Sat Dec 16 17:45:13 GMT 2023 , Edited by admin on Sat Dec 16 17:45:13 GMT 2023

PRIMARY

EPA CompTox

DTXSID30169199

Created by admin on Sat Dec 16 17:45:13 GMT 2023 , Edited by admin on Sat Dec 16 17:45:13 GMT 2023

PRIMARY

NCI_THESAURUS

C77278

Created by admin on Sat Dec 16 17:45:13 GMT 2023 , Edited by admin on Sat Dec 16 17:45:13 GMT 2023

PRIMARY

WIKIPEDIA

BETACETYLMETHADOL

Created by admin on Sat Dec 16 17:45:13 GMT 2023 , Edited by admin on Sat Dec 16 17:45:13 GMT 2023

PRIMARY

INN

353

Created by admin on Sat Dec 16 17:45:13 GMT 2023 , Edited by admin on Sat Dec 16 17:45:13 GMT 2023

PRIMARY

PUBCHEM

62710

Created by admin on Sat Dec 16 17:45:13 GMT 2023 , Edited by admin on Sat Dec 16 17:45:13 GMT 2023

PRIMARY

FDA UNII

905GLN509G

Created by admin on Sat Dec 16 17:45:13 GMT 2023 , Edited by admin on Sat Dec 16 17:45:13 GMT 2023

PRIMARY

SMS_ID

100000086094

Created by admin on Sat Dec 16 17:45:13 GMT 2023 , Edited by admin on Sat Dec 16 17:45:13 GMT 2023

PRIMARY

ChEMBL

CHEMBL2105619

Created by admin on Sat Dec 16 17:45:13 GMT 2023 , Edited by admin on Sat Dec 16 17:45:13 GMT 2023

PRIMARY

DRUG BANK

DB01522

Created by admin on Sat Dec 16 17:45:13 GMT 2023 , Edited by admin on Sat Dec 16 17:45:13 GMT 2023

PRIMARY

Related Record Type Details


					1PE72K8X46

MU-TYPE OPIOID RECEPTOR

TARGET -> AGONIST

Related Record Type Details


					905GLN509G

BETACETYLMETHADOL

ACTIVE MOIETY