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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H24NO7S.Mg.HO
Molecular Weight 439.763
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DEFERITAZOLE MAGNESIUM

SMILES

[OH-].[Mg++].COCCOCCOCCOC1=CC=CC(C2=N[C@](C)(CS2)C([O-])=O)=C1O

InChI

InChIKey=MVAWDZLMOYASSX-JPKZNVRTSA-L
InChI=1S/C18H25NO7S.Mg.H2O/c1-18(17(21)22)12-27-16(19-18)13-4-3-5-14(15(13)20)26-11-10-25-9-8-24-7-6-23-2;;/h3-5,20H,6-12H2,1-2H3,(H,21,22);;1H2/q;+2;/p-2/t18-;;/m1../s1

HIDE SMILES / InChI

Molecular Formula Mg
Molecular Weight 24.305
Charge 2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula HO
Molecular Weight 17.0073
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C18H24NO7S
Molecular Weight 398.451
Charge -1
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Deferitazole is an iron chelator, developed by the FerroKin BioSciences (later acquired by Shire, and then by Takeda). Deferitazole is a member of the desazadesferrithiocin class of siderophore-related tridentate chelators. It binds Fe(III) with very high affinity and selectivity over Fe(II) and other biologically important metals. Deferitazole was investigated in phase 2 clinical trials in patients with iron overload due to repeated red blood cell transfusion and beta-thalassemia, however, the development of the drug was discontinued. In preclinical models, deferitazole demonstrated efficacy for the treatment and prevention of malaria.

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 16:53:10 UTC 2023
Edited
by admin
on Fri Dec 15 16:53:10 UTC 2023
Record UNII
BG3Q8O5L5B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DEFERITAZOLE MAGNESIUM
USAN   WHO-DD  
USAN  
Official Name English
Deferitazole magnesium [WHO-DD]
Common Name English
DEFERITAZOLE MAGNESIUM [USAN]
Common Name English
FBS-0701 MAGNESIUM
Common Name English
Magnesium hydroxide (4S)-2-[2-hydroxy-3-(3,6,9-trioxadecyloxy)phenyl]-4-methyl-4,5-dihydrothiazole-4-carboxylate
Systematic Name English
SSP-004184AQ
Code English
MAGNESIUM HYDROXIDE (4S)-2-(2-HYDROXY-3-(2-(2-(2-METHOXYETHOXY)ETHOXY)ETHOXY)PHENYL)-4-METHYL-4,5-DIHYDRO-1,3-THIAZOLE-4-CARBOXYLATE
Systematic Name English
MAGNESIUM, (4S)-4,5-DIHYDRO-2-(2-HYDROXY-3-(2-(2-(2-METHOXYETHOXY)ETHOXY)ETHOXY)PHENYL)-4-METHYL-4-THIAZOLECARBOXYLATE HYDROXIDE (1:1:1)
Common Name English
FBS0701 MAGNESIUM
Common Name English
SPD-602 MAGNESIUM
Code English
Code System Code Type Description
FDA UNII
BG3Q8O5L5B
Created by admin on Fri Dec 15 16:53:10 UTC 2023 , Edited by admin on Fri Dec 15 16:53:10 UTC 2023
PRIMARY
USAN
YY-60
Created by admin on Fri Dec 15 16:53:10 UTC 2023 , Edited by admin on Fri Dec 15 16:53:10 UTC 2023
PRIMARY
PUBCHEM
135566057
Created by admin on Fri Dec 15 16:53:10 UTC 2023 , Edited by admin on Fri Dec 15 16:53:10 UTC 2023
PRIMARY
NCI_THESAURUS
C171822
Created by admin on Fri Dec 15 16:53:10 UTC 2023 , Edited by admin on Fri Dec 15 16:53:10 UTC 2023
PRIMARY
SMS_ID
300000044456
Created by admin on Fri Dec 15 16:53:10 UTC 2023 , Edited by admin on Fri Dec 15 16:53:10 UTC 2023
PRIMARY
CAS
1173092-59-5
Created by admin on Fri Dec 15 16:53:10 UTC 2023 , Edited by admin on Fri Dec 15 16:53:10 UTC 2023
PRIMARY
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ACTIVE MOIETY