Chemical Compound

Atosiban acetate

CAS Registry Number 914453-95-5
Atosiban acetate chemical structure
Primary Record

Atosiban acetate

In stock
7,470 g
Purity
99.8 %
CAS
914453-95-5

Compound Identifiers & Properties

CAS
914453-95-5
PubChem CID
162422678
SMILES
CC[C@H](C)C1C(=O)N[C@H](C(=O)NC(C(=O)N[C@@H](CSSCCC(=O)NC(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)OC(=O)C
Canonical SMILES
CCOc1ccc(CC2NC(=O)CCSSC[C@@H](C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)NC(=O)C(CC(N)=O)NC(=O)[C@H]([C@@H](C)OC(C)=O)NC(=O)C([C@@H](C)CC)NC2=O)cc1

Names & Synonyms

  • Atosiban acetate
  • BS-53358
  • 914453-95-5