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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H23ClN2O3.ClH
Molecular Weight 447.354
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SOLABEGRON HYDROCHLORIDE

SMILES

Cl.O[C@@H](CNCCNC1=CC=CC(=C1)C2=CC=CC(=C2)C(O)=O)C3=CC=CC(Cl)=C3

InChI

InChIKey=PMXCGBVBIRYFPR-FTBISJDPSA-N
InChI=1S/C23H23ClN2O3.ClH/c24-20-8-2-6-18(13-20)22(27)15-25-10-11-26-21-9-3-5-17(14-21)16-4-1-7-19(12-16)23(28)29;/h1-9,12-14,22,25-27H,10-11,15H2,(H,28,29);1H/t22-;/m0./s1

HIDE SMILES / InChI

Approval Year

Unknown
86413
Name Type Language
SOLABEGRON HYDROCHLORIDE
USAN   WHO-DD  
USAN  
Official Name English
Solabegron hydrochloride [WHO-DD]
Common Name English
3'-((2-(((2R)-2-(3-CHLOROPHENYL)-2-HYDROXYETHYL)AMINO)ETHYL)AMINO)BIPHENYL-3-CARBOXYLIC ACID HYDROCHLORIDE
Systematic Name English
GW427353B
Code English
(1,1'-BIPHENYL)-3-CARBOXYLIC ACID, 3'-((2-(((2R)-2-(3-CHLOROPHENYL)-2-HYDROXYETHYL)AMINO)ETHYL)AMINO)-, HYDROCHLORIDE
Common Name English
SOLABEGRON HYDROCHLORIDE [USAN]
Common Name English
GW-427353B
Code English
Classification Tree Code System Code
NCI_THESAURUS C48149
Created by admin on Fri Dec 15 18:30:01 UTC 2023 , Edited by admin on Fri Dec 15 18:30:01 UTC 2023
Code System Code Type Description
DRUG BANK
DBSALT001800
Created by admin on Fri Dec 15 18:30:01 UTC 2023 , Edited by admin on Fri Dec 15 18:30:01 UTC 2023
PRIMARY
USAN
PP-39
Created by admin on Fri Dec 15 18:30:01 UTC 2023 , Edited by admin on Fri Dec 15 18:30:01 UTC 2023
PRIMARY
EPA CompTox
DTXSID40963347
Created by admin on Fri Dec 15 18:30:01 UTC 2023 , Edited by admin on Fri Dec 15 18:30:01 UTC 2023
PRIMARY
FDA UNII
GU14FR8D4A
Created by admin on Fri Dec 15 18:30:01 UTC 2023 , Edited by admin on Fri Dec 15 18:30:01 UTC 2023
PRIMARY
CAS
451470-34-1
Created by admin on Fri Dec 15 18:30:01 UTC 2023 , Edited by admin on Fri Dec 15 18:30:01 UTC 2023
PRIMARY
ChEMBL
CHEMBL208427
Created by admin on Fri Dec 15 18:30:01 UTC 2023 , Edited by admin on Fri Dec 15 18:30:01 UTC 2023
PRIMARY
PUBCHEM
10297443
Created by admin on Fri Dec 15 18:30:01 UTC 2023 , Edited by admin on Fri Dec 15 18:30:01 UTC 2023
PRIMARY
NCI_THESAURUS
C96755
Created by admin on Fri Dec 15 18:30:01 UTC 2023 , Edited by admin on Fri Dec 15 18:30:01 UTC 2023
PRIMARY
ACTIVE MOIETY
Structure of SOLABEGRON
NIH
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