ETOMOXIR FREE ACID SODIUM MONOHYDRATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H18ClO4.Na.H2O
Molecular Weight	338.759
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ETOMOXIR FREE ACID SODIUM MONOHYDRATE

Structure Search

SMILES

O.[Na+].[O-]C(=O)[C@@]2(CCCCCCOC1=CC=C(Cl)C=C1)CO2

InChI

InChIKey=WENJLJJSJDAJDN-QCUBGVIVSA-M

InChI=1S/C15H19ClO4.Na.H2O/c16-12-5-7-13(8-6-12)19-10-4-2-1-3-9-15(11-20-15)14(17)18;;/h5-8H,1-4,9-11H2,(H,17,18);;1H2/q;+1;/p-1/t15-;;/m1../s1

HIDE SMILES / InChI

Molecular Formula	Na
Molecular Weight	22.98976928
Charge	1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	H2O
Molecular Weight	18.0153
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C15H18ClO4
Molecular Weight	297.754
Charge	-1
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
cholesterol biosynthetic process 4 Target ID: GO:0006695 Sources: https://www.ncbi.nlm.nih.gov/pubmed/1930298	Inhibitor 8504

Substance Class	Chemical Created by `admin` on `Wed Apr 02 13:44:37 GMT 2025` Edited by `admin` on `Wed Apr 02 13:44:37 GMT 2025`
Record UNII	AN6577AM7P
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ETOMOXIR FREE ACID SODIUM MONOHYDRATE

Common Name

English

ETOMOXIR SODIUM SALT HYDRATE

Preferred Name

English

2-OXIRANECARBOXYLIC ACID, 2-(6-(4-CHLOROPHENOXY)HEXYL)-, SODIUM SALT, HYDRATE (1:1:1), (2R)-

Systematic Name

English

Code System Code Type Description

FDA UNII

AN6577AM7P

Created by admin on Wed Apr 02 13:44:37 GMT 2025 , Edited by admin on Wed Apr 02 13:44:37 GMT 2025

PRIMARY

PUBCHEM

23675376

Created by admin on Wed Apr 02 13:44:37 GMT 2025 , Edited by admin on Wed Apr 02 13:44:37 GMT 2025

PRIMARY

CAS

1049724-28-8

Created by admin on Wed Apr 02 13:44:37 GMT 2025 , Edited by admin on Wed Apr 02 13:44:37 GMT 2025

PRIMARY

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