2-HYDROXYSACLOFEN

Details

Stereochemistry	RACEMIC
Molecular Formula	C9H12ClNO4S
Molecular Weight	265.714
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

NCC(O)(CS(O)(=O)=O)C1=CC=C(Cl)C=C1

InChI

InChIKey=WBSMZVIMANOCNX-UHFFFAOYSA-N

InChI=1S/C9H12ClNO4S/c10-8-3-1-7(2-4-8)9(12,5-11)6-16(13,14)15/h1-4,12H,5-6,11H2,(H,13,14,15)

HIDE SMILES / InChI

Molecular Formula	C9H12ClNO4S
Molecular Weight	265.714
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
GABA B receptor 6 Target ID: CHEMBL2111474 Sources: https://www.ncbi.nlm.nih.gov/pubmed/2164173	Antagonist 2849		5.1 µM [IC50]

PubMed

Title	Date	PubMed
Activaton of GABAB receptor inhibits the excitability of rat small diameter trigeminal root ganglion neurons.	2004	14698756
Expression cloning of GABA(B) receptors uncovers similarity to metabotropic glutamate receptors.	1997-03-20	9069281
Hypotensive and hypertensive effects of catecholamines intrathecally injected in anesthetized rats.	1996-06-10	8816361
Involvement of cholinergic systems in the deficit of place learning in Morris water maze task induced by baclofen in rats.	1995-06-19	7552356
2-Hydroxy-saclofen: an improved antagonist at central and peripheral GABAB receptors.	1988-09-23	2847092

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:10:24 GMT 2025` Edited by `admin` on `Mon Mar 31 22:10:24 GMT 2025`
Record UNII	X5IFR0UF10
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-HYDROXYSACLOFEN

Common Name

English

2-HYDROXY-S-(-)-SACLOFEN

Preferred Name

English

3-AMINO-2-(4-CHLOROPHENYL)-2-HYDROXY-PROPANE-1-SULFONIC ACID

Systematic Name

English

3-AMINO-2-(4-CHLOROPHENYL)-2-HYDROXYPROPANE-1-SULFONIC ACID

Systematic Name

English

2-HYDROXY-SACLOFEN

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID30922408

Created by admin on Mon Mar 31 22:10:24 GMT 2025 , Edited by admin on Mon Mar 31 22:10:24 GMT 2025

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PUBCHEM

1564

Created by admin on Mon Mar 31 22:10:24 GMT 2025 , Edited by admin on Mon Mar 31 22:10:24 GMT 2025

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CAS

117354-64-0

Created by admin on Mon Mar 31 22:10:24 GMT 2025 , Edited by admin on Mon Mar 31 22:10:24 GMT 2025

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FDA UNII

X5IFR0UF10

Created by admin on Mon Mar 31 22:10:24 GMT 2025 , Edited by admin on Mon Mar 31 22:10:24 GMT 2025

PRIMARY