Chemical Compound

NISIN

CAS Registry Number 1414-45-5
NISIN chemical structure
Primary Record

NISIN

In stock
6,604 g
Purity
98.7 %
CAS
1414-45-5

Compound Identifiers & Properties

CAS
1414-45-5
PubChem CID
156599057
SMILES
CCC(C)C1C(=O)NC(=C)C(=O)NC(C(=O)NC(CSCC(C(=O)N1)NC(=O)C(=CC)NC(=O)C(C(C)CC)N)C(=O)NC2C(SCC(NC(=O)CNC(=O)C3CCCN3C2=O)C(=O)N[C@H](CCCCN)C(=O)NC4C(SCC(NC(=O)CNC(=O)C(NC(=O)C(NC(=O)C(NC(=O)CNC4=O)C)CC(C)C)CCSC)C(=O)NC(CC(=O)N)C(=O)N[C@H](CCSC)C(=O)N[C@H](CCCCN)C(=O)NC5C(SCC6C(=O)NC(C(=O)NC(CSC(C(C(=O)N6)NC(=O)C(NC5=O)C)C)C(=O)N[C@H](CO)C(=O)N[C@H](C(C)CC)C(=O)N[C@@H](CC7=CN=CN7)C(=O)NC(C(C)C)C(=O)NC(=C)C(=O)NC(CCCCN)C(=O)O)CC8=CN=CN8)C)C)C)CC(C)C
Canonical SMILES
C=C(NC(=O)C(NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](NC(=O)[C@@H](CO)NC(=O)C1CSC(C)C2NC(=O)C(C)NC(=O)C(NC(=O)[C@@H](CCCCN)NC(=O)[C@@H](CCSC)NC(=O)C(CC(N)=O)NC(=O)C3CSC(C)C(NC(=O)[C@@H](CCCCN)NC(=O)C4CSC(C)C(NC(=O)C5CSCC(NC(=O)C(=CC)NC(=O)C(N)C(C)CC)C(=O)NC(C(C)CC)C(=O)NC(=C)C(=O)NC(CC(C)C)C(=O)N5)C(=O)N5CCCC5C(=O)NCC(=O)N4)C(=O)NCC(=O)NC(C)C(=O)NC(CC(C)C)C(=O)NC(CCSC)C(=O)NCC(=O)N3)C(C)SCC(NC2=O)C(=O)NC(Cc2cnc[nH]2)C(=O)N1)C(C)CC)C(C)C)C(=O)NC(CCCCN)C(=O)O

Names & Synonyms

  • NISIN
  • Nisin A, Technical grade (~2.5% mainly sodium chloride and denatured milk solids)
  • 1-Thia-4,7,10,13,16,19-hexaazacyclodocosane, cyclic peptide deriv.; 1-Thia-4,7,10,13-tetraazacyclohexadecane, cyclic peptide deriv.; 1H,9H-Pyrrolo[2,1-i][1,4,7,10]thiatriazacyclotridecine, cyclic peptide deriv.; 9,19-Dithia-2,5,13,16,22-pentaazabicyclo[9.9.2]docosane, cyclic peptide deriv.; Ambicin N; Delvoplus; L-Isoleucyl-(Z)-2,3-didehydro-2-aminobutanoyl-D-cysteinyl-L-isoleucyl-2,3-didehydroalanyl-L-leucyl-L-cysteinyl-threo-3-mercapto-D-2-aminobutanoyl-L-prolylglycyl-L-cysteinyl-L-lysyl-threo-3-mercapto-D-2-aminobutanoylglycyl-L-alanyl-L-leucyl-L-methionylglycyl-L-cysteinyl-L-asparaginyl-L-methionyl-L-lysyl-threo-3-mercapto-D-2-aminobutanoyl-L-alanyl-threo-3-mercapto-D-2-aminobutanoyl-L-cysteinyl-L-histidyl-L-cysteinyl-L-seryl-L-isoleucyl-L-histidyl-L-valyl-2,3-didehydroalanyl-L-lysine Cyclic (3-7),(8-11),(13-19),(23-26),(25-28)-pentakis(sulfide); MicroGARD MG 300; Natural-Keeper; Nis
  • 1414-45-5