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ζ-Stat trisodium

CAT: 0013-GTR19236795-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19236795-01Size:10 mg
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Description
ζ-Stat trisodium (NSC37044 trisodium) is a specific and atypical PKC-ζ inhibitor, with an IC50 of 5 μM. ζ-Stat trisodium can reduce melanoma cell lines proliferation and induce apoptosis, and has antitumor activity in vitro.
CAS Number
31894-34-5
Field of Research
Signal Transduction
Purity
>98%
Smiles
[Na+].[Na+].[Na+].O=S (C1=CC (O) =C2C (S ([O-]) (=O) =O) =CC (=CC2=C1) S ([O-]) (=O) =O) (=O) [O-]
Molecular Formula
C10H5O10S3-3.3[NA+]
Molecular Weight
450.3051
Notes
For research use only.

Chemical Information

zeta-Stat trisodium
CAS Number31894-34-5
PubChem CID90471481
IUPAC Nametrisodium;8-hydroxynaphthalene-1,3,6-trisulfonate
Molecular FormulaC10H5Na3O10S3
Molecular Weight450.3
Topological Polar Surface Area217
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count0
Heavy Atom Count26
Formal Charge0
Complexity711
SMILES
C1=C2C=C(C=C(C2=C(C=C1S(=O)(=O)[O-])O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]
InChI
InChI=1S/C10H8O10S3.3Na/c11-8-3-6(21(12,13)14)1-5-2-7(22(15,16)17)4-9(10(5)8)23(18,19)20;;;/h1-4,11H,(H,12,13,14)(H,15,16,17)(H,18,19,20);;;/q;3*+1/p-3
InChIKey
VQXXRDCDIFAODW-UHFFFAOYSA-K
Chemical Structure
2D Structure
2D structure of zeta-Stat trisodium
CAS: 31894-34-5
CID: 90471481
Formula: C10H5Na3O10S3
MW: 450.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight450.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count0
Exact Mass449.87379272
Monoisotopic Mass449.87379272
Topological Polar Surface Area217 Ų
Heavy Atom Count26
Formal Charge0
Complexity711
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count4
Compound Is CanonicalizedYes

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