Chemical Compound

Bacitracin I1

CAS Registry Number 167289-62-5
Bacitracin I1 chemical structure
Primary Record

Bacitracin I1

In stock
8,924 g
Purity
99.4 %
CAS
167289-62-5

Compound Identifiers & Properties

CAS
167289-62-5
PubChem CID
156613862
SMILES
CC[C@H](C)[C@@H](C(=O)N[C@H]1CCCCNC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@H](NC1=O)CCCN)C(C)C)CC2=CC=CC=C2)CC3=CN=CN3)CC(=O)O)CC(=O)N)NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)C4=CSC(=N4)C(=O)C(C)C
Canonical SMILES
CC[C@H](C)[C@H](NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)c1csc(C(=O)C(C)C)n1)C(=O)N[C@H]1CCCCNC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](CCCN)NC1=O

Names & Synonyms

  • Bacitracin I1
  • Bacitracin EP Impurity I
  • W45HAN7NR4
  • UNII-W45HAN7NR4
  • Bacitracin impurity I [EP]
  • BACITRACIN IMPURITY I [EP IMPURITY]
  • 167289-62-5
  • 4,10-ANHYDRO(N-((2-(2-METHYL-1-OXOPROPYL)-1,3-THIAZOL-4-YL)CARBONYL)-L-LEUCYL-D-.ALPHA.-GLUTAMYL-L-ISOLEUCYL-L-LYSYL-D-ORNITHYL-L-VALYL-D-PHENYLALANYL-L-HISTIDYL-D-.ALPHA.-ASPARTYL-L-ASPARAGINE)
  • 4,10-Anhydro(N-((2-(2-methyl-1-oxopropyl)-1,3-thiazol-4-yl)carbonyl)-L-leucyl-D-alpha-glutamyl-L-isoleucyl-L-lysyl-D-ornithyl-L-valyl-D-phenylalanyl-L-histidyl-D-alpha-aspartyl-L-asparagine)
  • L-ASPARAGINE, N-((2-(2-METHYL-1-OXOPROPYL)-4-THIAZOLYL)CARBONYL)-L-LEUCYL-D-.ALPHA.-GLUTAMYL-L-ISOLEUCYL-L-LYSYL-D-ORNITHYL-L-VALYL-D-PHENYLALANYL-L-HISTIDYL-D-.ALPHA.-ASPARTYL-, CYCLIC (10->4)-PEPTIDE
  • L-Asparagine, N-((2-(2-methyl-1-oxopropyl)-4-thiazolyl)carbonyl)-L-leucyl-D-alpha-glutamyl-L-isoleucyl-L-lysyl-D-ornithyl-L-valyl-D-phenylalanyl-L-histidyl-D-alpha-aspartyl-, cyclic (10->4)-peptide