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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H26ClNO4
Molecular Weight 403.899
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AMIBEGRON

SMILES

CCOC(=O)COC1=CC2=C(CC[C@@H](C2)NC[C@H](O)C3=CC=CC(Cl)=C3)C=C1

InChI

InChIKey=RDJQCOBTKKAQAH-FPOVZHCZSA-N
InChI=1S/C22H26ClNO4/c1-2-27-22(26)14-28-20-9-7-15-6-8-19(11-17(15)12-20)24-13-21(25)16-4-3-5-18(23)10-16/h3-5,7,9-10,12,19,21,24-25H,2,6,8,11,13-14H2,1H3/t19-,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H26ClNO4
Molecular Weight 403.899
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 17:55:12 UTC 2023
Edited
by admin
on Sat Dec 16 17:55:12 UTC 2023
Record UNII
PDQ3ME68U3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AMIBEGRON
INN   USAN   WHO-DD  
USAN   INN  
Official Name English
Amibegron [WHO-DD]
Common Name English
AMIBEGRON [USAN]
Common Name English
SR58611
Code English
amibegron [INN]
Common Name English
ACETIC ACID, (((7S)-7-(((2R)-2-(3-CHLOROPHENYL)-2-HYDROXYETHYL)AMINO)-5,6,7,8-TETRAHYDRO-2-NAPHTHALENYL)OXY)-, ETHYL ESTER
Common Name English
Ethyl {[(7S)-7-{[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]amino}-5,6,7,8-tetrahydronaphthalen-2-yl]oxy}acetate
Systematic Name English
SR-58611
Code English
Classification Tree Code System Code
NCI_THESAURUS C48149
Created by admin on Sat Dec 16 17:55:13 UTC 2023 , Edited by admin on Sat Dec 16 17:55:13 UTC 2023
Code System Code Type Description
ChEMBL
CHEMBL1193948
Created by admin on Sat Dec 16 17:55:13 UTC 2023 , Edited by admin on Sat Dec 16 17:55:13 UTC 2023
PRIMARY
PUBCHEM
3035442
Created by admin on Sat Dec 16 17:55:13 UTC 2023 , Edited by admin on Sat Dec 16 17:55:13 UTC 2023
PRIMARY
INN
8687
Created by admin on Sat Dec 16 17:55:13 UTC 2023 , Edited by admin on Sat Dec 16 17:55:13 UTC 2023
PRIMARY
USAN
UU-11
Created by admin on Sat Dec 16 17:55:13 UTC 2023 , Edited by admin on Sat Dec 16 17:55:13 UTC 2023
PRIMARY
WIKIPEDIA
AMIBEGRON
Created by admin on Sat Dec 16 17:55:13 UTC 2023 , Edited by admin on Sat Dec 16 17:55:13 UTC 2023
PRIMARY
DRUG BANK
DB05395
Created by admin on Sat Dec 16 17:55:13 UTC 2023 , Edited by admin on Sat Dec 16 17:55:13 UTC 2023
PRIMARY
FDA UNII
PDQ3ME68U3
Created by admin on Sat Dec 16 17:55:13 UTC 2023 , Edited by admin on Sat Dec 16 17:55:13 UTC 2023
PRIMARY
NCI_THESAURUS
C77932
Created by admin on Sat Dec 16 17:55:13 UTC 2023 , Edited by admin on Sat Dec 16 17:55:13 UTC 2023
PRIMARY
MESH
C076252
Created by admin on Sat Dec 16 17:55:13 UTC 2023 , Edited by admin on Sat Dec 16 17:55:13 UTC 2023
PRIMARY
CAS
121524-08-1
Created by admin on Sat Dec 16 17:55:13 UTC 2023 , Edited by admin on Sat Dec 16 17:55:13 UTC 2023
PRIMARY
EPA CompTox
DTXSID6047361
Created by admin on Sat Dec 16 17:55:13 UTC 2023 , Edited by admin on Sat Dec 16 17:55:13 UTC 2023
PRIMARY
SMS_ID
100000175033
Created by admin on Sat Dec 16 17:55:13 UTC 2023 , Edited by admin on Sat Dec 16 17:55:13 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> AGONIST
SHORT-ACTING
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY