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Abacavir

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Category Human immunodeficiency Virus (HIV)
CAS 136470-78-5
Description Abacavir sulfate is a Nucleoside analog reverse transcriptase inhibitor (NRTI); guanosine analog used to treat HIV and AIDS.
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Product Information

Synonyms Ziagen
Molecular Weight 286.33
Molecular Formula C14H18N6O
Canonical SMILES C1CC1NC2=NC(=NC3=C2N=CN3C4CC(C=C4)CO)N
InChI InChI=1S/C14H18N6O/c15-14-18-12(17-9-2-3-9)11-13(19-14)20(7-16-11)10-4-1-8(5-10)6-21/h1,4,7-10,21H,2-3,5-6H2,(H3,15,17,18,19)/t8-,10+/m1/s1
InChIKey MCGSCOLBFJQGHM-SCZZXKLOSA-N
Boiling Point 636.0±65.0 °C at 760 mmHg
Melting Point 161 °C(dec.)
Flash Point 338.4±34.3 °C
Purity >98%
Density 1.7±0.1 g/cm3
Solubility In Vitro:
DMSO: ≥ 3 mg/mL (10.48 mM)
Appearance White to off-white (Solid)
Storage Powder:
-20°C: 3 years
4°C: 2 years
In solvent:
-80°C: 6 months
-20°C: 1 month
Complexity 414
Exact Mass 286.15420922
Index Of Refraction 1.864
In Vitro Abacavir (15 and 150 μM, 0-120 h) inhibits cell growth, affects cell cycle progression, induces senescence and modulates LINE-1 mRNA expression in prostate cancer cell lines, and it significantly reduces cell migration and inhibits cell invasion.
In Vivo Abacavir (100 and 200 mg/kg, p.o.; 4 h) dose-dependently promoted thrombus formation, and enhances survival of high-risk medulloblastoma-bearing mice.
PSA 101.88000
Target HIV; Reverse Transcriptase; Telomerase; Apoptosis
Vapor Pressure 0.0±2.0 mmHg at 25°C
XLogP3-AA 0.9

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