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Atosiban

CHEBI:CHEBI_135899

Chemical Information

Molecular Formula
C43H67N11O12S2
Molecular Mass
994.192
Charge
0
SMILES
C1=C(C=CC(=C1)OCC)C[C@H]2NC(=O)CCSSC[C@H](NC([C@@H](NC([C@@](NC([C@@](NC2=O)([C@@H](C)CC)[H])=O)([C@@H](C)O)[H])=O)CC(N)=O)=O)C(N3CCC[C@H]3C(N[C@H](C(=O)NCC(=O)N)CCCN)=O)=O
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

Alternative Names

  • antocin
  • Antocin II
  • atosiban acetate
  • tractocil
  • tractocile

Treatment Applications

Drug Classification

Important Medical Information

⚕️ This information is sourced from ChEBI (Chemical Entities of Biological Interest) database and is intended for educational purposes only.

  • Always consult with a healthcare professional before starting, stopping, or modifying any medication.
  • Side effects may vary and this list may not be comprehensive.
  • Drug interactions may occur with other medications.

Additional Identifiers

DRON_00010000
59639
oboInOwl#hasDbXref
Drug_Central:3008
core#notation
CHEBI:135899

Additional References

🔍 Click on any linked disease name to learn more about the conditions this medication is used to treat, or explore related drug classifications for more information about similar medications.

Additional Attributes

oboInOwl#hasOBONamespace
chebi_ontology
DRON_00010000
59639
oboInOwl#hasDbXref
Drug_Central:3008
oboInOwl#id
CHEBI:135899
core#notation
CHEBI:135899
oboInOwl#inSubset
http://purl.obolibrary.org/obo/chebi#2_STAR
22-rdf-syntax-ns#type
http://www.w3.org/2002/07/owl#Class
rdf-schema#range
https://w3id.org/def/predibionto#has_drug_106635
owl#annotatedSource
t108875
owl#someValuesFrom
t570842