Chemical Compound

Caerulein ammonium salt

CAS Registry Number 17650-98-5
Caerulein ammonium salt chemical structure
Primary Record

Caerulein ammonium salt

In stock
9,198 g
Purity
98.9 %
CAS
17650-98-5

Compound Identifiers & Properties

CAS
17650-98-5
PubChem CID
171034926
SMILES
CCNCC.CC(C(C(=O)NCC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC(CCSC)C(=O)NC(CC(=O)O)C(=O)NC(CC3=CC=CC=C3)C(=O)N)NC(=O)C(CC4=CC=C(C=C4)OS(=O)(=O)O)NC(=O)C(CC(=O)O)NC(=O)C(CCC(=O)N)NC(=O)C5CCC(=O)N5)O
Canonical SMILES
CCNCC.CSCCC(NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)C(NC(=O)C(Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)C(CC(=O)O)NC(=O)C(CCC(N)=O)NC(=O)C1CCC(=O)N1)C(C)O)C(=O)NC(CC(=O)O)C(=O)NC(Cc1ccccc1)C(N)=O

Names & Synonyms

  • Caerulein ammonium salt
  • 17650-98-5