Atosiban
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Atosiban
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CAS No:
90779-69-4
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Formula:
C45H71N11O14S2
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Chemical Name:
Atosiban
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Synonyms:
Atosiban;rwj22164;Human Atosiban;ATOSIBAN ACETATE;Oxytropis Falcata;Atosiban, RWJ 22164;Atosiban impurity 1;AtosibanAcetate(Tractocile);1-deamino-2d-tyr-(oet)-4-thr-8-orn-oxytocin;1-Deamino-2-D-Tyr-(O-ethyl)-4-Thr-8-ornoxytocin
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CAS No:
Description
Atosiban(RW22164; Tractocile) is a nonapeptide, desamino-oxytocin analogue, and a competitive vasopressin/oxytocin receptor antagonist (VOTra). Atosiban inhibits the oxytocin-mediated release of inositol trisphosphate from the myometrial cell membrane.IC50 value:Target: As a result, there is reduced release of intracellular, stored calcium from the sarcoplasmic reticulum of myometrial cells, and reduced influx of Ca2+ from the extracellular space through voltage gated channels. In additi
Characteristics
416.27000
-3.41
solid
1.3±0.1 g/cm3
1469.0±65.0 °C at 760 mmHg
842.2±34.3 °C
1.549
H2O: ≤100 mg/mL
−20°C
Atosiban Use and Manufacturing
Atosiban is an oxytocin receptor blocking agent in the treatment of experimental endometriosis and was shown exhibit significant therapeutic efficiency.
Computed Properties
Molecular Weight:994.2
XLogP3:-1.9
Hydrogen Bond Donor Count:11
Hydrogen Bond Acceptor Count:15
Rotatable Bond Count:18
Exact Mass:993.44120896
Monoisotopic Mass:993.44120896
Topological Polar Surface Area:416
Heavy Atom Count:68
Complexity:1770
Defined Atom Stereocenter Count:8
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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