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Danegaptide Hydrochloride

CAT: 0013-GTR19173047-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19173047-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Danegaptide Hydrochloride (GAP-134) is a selective gap junction modifier. It has been investigated in preclinical research for its potential cardioprotective effects, particularly in models of cardiac arrhythmia and ischemia-reperfusion injury, in both in vitro and in vivo studies.
CAS Number
943133-81-1
Product Name Alternative
Dipeptide, Danegaptide, Danegaptide Hydrochloride, Cardioprotective, antiarrhythmic, Inhibitor, Gap Junction Protein, GAP 134, Gap junction., GAP134, GAP-134, GAP-134 (Hydrochloride), GapJunctionProtein, orally, inhibit, ZP 1609, ZP 1609 Hydrochloride, ZP1609, ZP-1609, ZP1609 Hydrochloride, ZP-1609 Hydrochloride
Field of Research
Signal Transduction
Purity
99.55% (May vary between batches)
Solubility
DMSO:50 mg/mL (152.55 mM) ; H2O:50 mg/mL (152.55 mM)
Smiles
Cl.NCC (=O) N1C[C@@H] (C[C@H]1C (O) =O) NC (=O) c1ccccc1
Molecular Formula
C14H18ClN3O4
Molecular Weight
327.76
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Danegaptide Hydrochloride
CAS Number943133-81-1
PubChem CID44563896
IUPAC Name(2S,4R)-1-(2-aminoacetyl)-4-benzamidopyrrolidine-2-carboxylic acid;hydrochloride
Molecular FormulaC14H18ClN3O4
Molecular Weight327.76
Topological Polar Surface Area113
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count22
Formal Charge0
Complexity420
SMILES
C1[C@H](CN([C@@H]1C(=O)O)C(=O)CN)NC(=O)C2=CC=CC=C2.Cl
InChI
InChI=1S/C14H17N3O4.ClH/c15-7-12(18)17-8-10(6-11(17)14(20)21)16-13(19)9-4-2-1-3-5-9;/h1-5,10-11H,6-8,15H2,(H,16,19)(H,20,21);1H/t10-,11+;/m1./s1
InChIKey
AHXPMNACLWKFRQ-DHXVBOOMSA-N
Chemical Structure
2D Structure
2D structure of Danegaptide Hydrochloride
CAS: 943133-81-1
CID: 44563896
Formula: C14H18ClN3O4
MW: 327.76
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight327.76
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass327.0985838
Monoisotopic Mass327.0985838
Topological Polar Surface Area113 Ų
Heavy Atom Count22
Formal Charge0
Complexity420
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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