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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H29NO
Molecular Weight 311.4611
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BETAMETHADOL

SMILES

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

InChI

InChIKey=QIRAYNIFEOXSPW-XLIONFOSSA-N
InChI=1S/C21H29NO/c1-5-20(23)21(16-17(2)22(3)4,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6-15,17,20,23H,5,16H2,1-4H3/t17-,20+/m1/s1

HIDE SMILES / InChI
Molecular Formula C21H29NO
Molecular Weight 311.4611
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Description

Betamethadol or β-methadol is an opioid analgesic under international control according to the UN Single Convention 1961. Betamethadol is an isomer of the racemic mixture of dimepheptanol.

Approval Year

Unknown
139594
Substance Class Chemical
Created
by admin
on Fri Dec 15 16:06:38 GMT 2023
Edited
by admin
on Fri Dec 15 16:06:38 GMT 2023
Record UNII
57ANR1Z628
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BETAMETHADOL
INN  
INN  
Official Name English
BENZENEETHANOL, .BETA.-((2R)-2-(DIMETHYLAMINO)PROPYL)-.ALPHA.-ETHYL-.BETA.-PHENYL-, (.ALPHA.S)-
Systematic Name English
.BETA.-METHADOL
Common Name English
(3S,6R)-6-DIMETHYLAMINO-4,4-DIPHENYL-3-HEPTANOL
Systematic Name English
.BETA.-6-DIMETHYLAMINO-4,4-DIPHENYL-3-HEPTANOL
Common Name English
betamethadol [INN]
Common Name English
ACSCN-9609
Common Name English
IDS-NB-005
Code English
.BETA.-METHADOL, (-)-
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C67413
Created by admin on Fri Dec 15 16:06:38 GMT 2023 , Edited by admin on Fri Dec 15 16:06:38 GMT 2023
DEA NO. 9609
Created by admin on Fri Dec 15 16:06:38 GMT 2023 , Edited by admin on Fri Dec 15 16:06:38 GMT 2023
Code System Code Type Description
FDA UNII
57ANR1Z628
Created by admin on Fri Dec 15 16:06:38 GMT 2023 , Edited by admin on Fri Dec 15 16:06:38 GMT 2023
PRIMARY
PUBCHEM
10064061
Created by admin on Fri Dec 15 16:06:39 GMT 2023 , Edited by admin on Fri Dec 15 16:06:39 GMT 2023
PRIMARY
EPA CompTox
DTXSID501017192
Created by admin on Fri Dec 15 16:06:38 GMT 2023 , Edited by admin on Fri Dec 15 16:06:38 GMT 2023
PRIMARY
CAS
17199-55-2
Created by admin on Fri Dec 15 16:06:38 GMT 2023 , Edited by admin on Fri Dec 15 16:06:38 GMT 2023
PRIMARY
EVMPD
SUB05796MIG
Created by admin on Fri Dec 15 16:06:38 GMT 2023 , Edited by admin on Fri Dec 15 16:06:38 GMT 2023
PRIMARY
SMS_ID
100000085868
Created by admin on Fri Dec 15 16:06:39 GMT 2023 , Edited by admin on Fri Dec 15 16:06:39 GMT 2023
PRIMARY
WIKIPEDIA
BETAMETHADOL
Created by admin on Fri Dec 15 16:06:39 GMT 2023 , Edited by admin on Fri Dec 15 16:06:39 GMT 2023
PRIMARY
INN
470
Created by admin on Fri Dec 15 16:06:38 GMT 2023 , Edited by admin on Fri Dec 15 16:06:38 GMT 2023
PRIMARY
NCI_THESAURUS
C77279
Created by admin on Fri Dec 15 16:06:38 GMT 2023 , Edited by admin on Fri Dec 15 16:06:38 GMT 2023
PRIMARY
ChEMBL
CHEMBL162243
Created by admin on Fri Dec 15 16:06:38 GMT 2023 , Edited by admin on Fri Dec 15 16:06:38 GMT 2023
PRIMARY
Related Record Type Details
Structure of BETAMETHADOL
ACTIVE MOIETY
NIH
NCATS
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