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
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
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
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 16:53:10 GMT 2023
by
admin
on
Fri Dec 15 16:53:10 GMT 2023
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Record UNII |
BG3Q8O5L5B
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Record Status |
Validated (UNII)
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Record Version |
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-
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BG3Q8O5L5B
Created by
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YY-60
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135566057
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C171822
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300000044456
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1173092-59-5
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admin on Fri Dec 15 16:53:10 GMT 2023 , Edited by admin on Fri Dec 15 16:53:10 GMT 2023
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PARENT -> SALT/SOLVATE |
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ACTIVE MOIETY |