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6,6'-Dithiodinicotinic Acid

CAT: 1410-M28914-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M28914-01Size:5 mg
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Description
6,6'-Dithiodinicotinic Acid is a non permeant thiol agent which affects several mitochondrial functions. In rat liver mitochondria, 6,6'-Dithiodinicotinic Acid inhibits only the Pi/OH- carrier; both 6,6'-Dithiodinicotinic Acid and n-butylmalonate are necessary to inhibit completely Pi entry.
CAS Number
15658-35-2
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
308.33
Molecular Formula
C12H8N2O4S2
Notes
Research use only, not for human use.
Receptor
Ferroptosis

Chemical Information

6,6'-Dithiodinicotinic acid

RN given refers to parent cpd; structure

CAS Number15658-35-2
PubChem CID85040
IUPAC Name6-[(5-carboxy-2-pyridinyl)disulfanyl]pyridine-3-carboxylic acid
Molecular FormulaC12H8N2O4S2
Molecular Weight308.3
XLogP1.6
Topological Polar Surface Area151
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count5
Heavy Atom Count20
Formal Charge0
Complexity335
SMILES
C1=CC(=NC=C1C(=O)O)SSC2=NC=C(C=C2)C(=O)O
InChI
InChI=1S/C12H8N2O4S2/c15-11(16)7-1-3-9(13-5-7)19-20-10-4-2-8(6-14-10)12(17)18/h1-6H,(H,15,16)(H,17,18)
InChIKey
GSASOFRDSIKDSN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 6,6'-Dithiodinicotinic acid
CAS: 15658-35-2
CID: 85040
Formula: C12H8N2O4S2
MW: 308.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight308.3
XLogP31.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count5
Exact Mass307.99254909
Monoisotopic Mass307.99254909
Topological Polar Surface Area151 Ų
Heavy Atom Count20
Formal Charge0
Complexity335
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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