Atosiban

  • CAT Number: I005420
  • CAS Number: 90779-69-4
  • Molecular Formula: C43H67N11O12S2
  • Molecular Weight: 994.2
  • Purity: ≥95%
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Atosiban (Cat.No:I005420) is a synthetic peptide used as a tocolytic agent to delay or inhibit premature labor. It acts as an antagonist of the hormone oxytocin, which stimulates uterine contractions. Atosiban competitively binds to the oxytocin receptor, inhibiting the oxytocin-induced contractions. It is commonly administered by injection and has a relatively short half-life.

Catalog Number I005420
CAS Number 90779-69-4
Molecular Formula

C43H67N11O12S2

Purity 95%
Target Vasopressin Receptor
Solubility DMSO: < 10.3 mg/mL
Storage Store at -20°C
IUPAC Name (2S)-N-[(2S)-5-amino-1-[(2-amino-2-oxoethyl)amino]-1-oxopentan-2-yl]-1-[(4R,7S,10S,13S,16R)-7-(2-amino-2-oxoethyl)-13-[(2S)-butan-2-yl]-16-[(4-ethoxyphenyl)methyl]-10-[(1R)-1-hydroxyethyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]pyrrolidine-2-carboxamide
InChI InChI=1S/C43H67N11O12S2/c1-5-23(3)35-41(63)53-36(24(4)55)42(64)50-29(20-32(45)56)38(60)51-30(43(65)54-17-8-10-31(54)40(62)49-27(9-7-16-44)37(59)47-21-33(46)57)22-68-67-18-15-34(58)48-28(39(61)52-35)19-25-11-13-26(14-12-25)66-6-2/h11-14,23-24,27-31,35-36,55H,5-10,15-22,44H2,1-4H3,(H2,45,56)(H2,46,57)(H,47,59)(H,48,58)(H,49,62)(H,50,64)(H,51,60)(H,52,61)(H,53,63)/t23-,24+,27-,28+,29-,30-,31-,35-,36-/m0/s1
InChIKey VWXRQYYUEIYXCZ-OBIMUBPZSA-N
SMILES CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSCCC(=O)N[C@@H](C(=O)N1)CC2=CC=C(C=C2)OCC)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCN)C(=O)NCC(=O)N)CC(=O)N)[C@@H](C)O InChIKey: VWXRQYYUEIYXCZ-OBIMUBPZSA-N
Reference

<p>
[1]. Sanu O, et al. Critical appraisal and clinical utility of atosiban in the management of preterm labor. Ther Clin Risk Manag. 2010 Apr 26;6:191-9.&nbsp;
</p>
<p>
[2]. Akerlund M, et al. The effect on the human uterus of two newly developed competitive inhibitors of oxytocin and vasopressin. Acta Obstet Gynecol Scand. 1985;64(6):499-504.
</p>

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