Tioxolone - CAS 4991-65-5
Catalog number: 4991-65-5
Category: Inhibitor
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Molecular Formula:
C7H4O3S
Molecular Weight:
168.17
COA:
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Targets:
Carbonic Anhydrase
Description:
Tioxolone is a metalloenzyme carbonic anhydrase I inhibitor with a Ki of 91 nM.
Purity:
>98%
MSDS:
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InChIKey:
SLYPOVJCSQHITR-UHFFFAOYSA-N
InChI:
InChI=1S/C7H4O3S/c8-4-1-2-6-5(3-4)10-7(9)11-6/h1-3,8H
Canonical SMILES:
C1=CC2=C(C=C1O)OC(=O)S2
1.The supramolecular structure of 6-hydroxy-1,3-benzoxathiol-2-one (tioxolone).
Byres M1, Cox PJ. Acta Crystallogr C. 2004 Jun;60(Pt 6):o395-6. Epub 2004 May 11.
The planar molecules of 6-hydroxy-1,3-benzoxathiol-2-one, C(7)H(4)O(3)S, are linked by extensive O-H.O and C-H.O hydrogen bonding and are further stablilized by face-to-face pi-pi interactions.
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CAS 4991-65-5 Tioxolone

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