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1051366-32-5

1051366-32-5 Structure

1051366-32-5 Structure
IdentificationBack Directory
[Name]

11-Dideuterolinoleic acid
[CAS]

1051366-32-5
[Synonyms]

POL-6326)
Balixafortide TFA salt
Balixafortide (POL6326
11-Dideuterolinoleic acid
Cyclo[L-alanyl-L-cysteinyl-L-seryl-L-alanyl-D-prolyl-(2S)-2,4-diaminobutanoyl-L-arginyl-L-tyrosyl-L-cysteinyl-L-tyrosyl-L-glutaminyl-L-lysyl-D-prolyl-L-prolyl-L-tyrosyl-L-histidyl], cyclic (2→9)-disulfide
[Molecular Formula]

C84H118N24O21S2
[MDL Number]

MFCD34187225
[MOL File]

1051366-32-5.mol
[Molecular Weight]

1864.11
Chemical PropertiesBack Directory
[density ]

1.58±0.1 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

DMSO:100.0(Max Conc. mg/mL);45.33(Max Conc. mM)
Water:100.0(Max Conc. mg/mL);45.33(Max Conc. mM)
[pka]

9.89±0.15(Predicted)
[Water Solubility ]

Water: 100 mg/mL (53.64 mM);
[Sequence]

H-Ala-Cys-Ser-Ala-Pro-Arg-Tyr-Cys-Tyr-Gln-Lys-Pro-Pro-Tyr-His-OH(Disulfide bridges Cys-Cys)
Hazard InformationBack Directory
[Uses]

Balixafortide (POL6326) is a potent, selective, well-tolerated peptidic CXCR4 antagonist with an IC50 < 10 nM. Balixafortide shows 1000-fold selective for CXCR4 than a large panel of receptors including CXCR7. Balixafortide blocks β-arrestin recruitment and calcium flux with IC50s < 10 nM. Balixafortide is also a potent hematopoietic stem and progenitor cell (HSPC) mobilizing agent. Anti-cancer effects[1][2].
[in vivo]

Balixafortide is optimized for favorable mouse absorption, distribution, metabolism and excretion (ADME) properties with balanced plasma protein binding, greater plasma and microsomal stability[1].

[IC 50]

CXCR4: <10 nM (IC50)
[References]

[1] Zimmermann J, et al. Anti-tumor cell activity and in vitro profile of the next generation CXCR4 antagonist Balixafortide. Ann Oncol. 2018 Oct;29 Suppl 8:viii103.
[2] Karpova D, et al. Mobilization of hematopoietic stem cells with the novel CXCR4 antagonist POL6326 (balixafortide) in healthy volunteers-results of a dose escalation trial. J Transl Med. 2017 Jan 3;15(1):2. DOI:10.1186/s12967-016-1107-2
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