Chemical Compound

C226H338N60O66S

CAS Registry Number 100040-31-1
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C226H338N60O66S chemical structure
Primary Record

C226H338N60O66S

In stock
7,779 g
Purity
99.2 %
CAS
100040-31-1

Compound Identifiers & Properties

CAS
100040-31-1
PubChem CID
176447249
SMILES
CCC(C)C(C(=NC(CC1=CN=CN1)C(=NC(CCC(=N)O)C(=NC(CCC(=N)O)C(=NC(CC(=O)O)C(=NC(CC2=CC=CC=C2)C(=NC(C(C)C)C(=NC(CC(=N)O)C(=NC(CC3=CNC4=CC=CC=C43)C(=NC(CC(C)C)C(=NC(CC(C)C)C(=NC(C)C(=NC(CCC(=N)O)C(=NC(CCCCN)C(=NCC(=NC(CCCCN)C(=NC(CCCCN)C(=NC(CC(=N)O)C(=NC(CC(=O)O)C(=NC(CC5=CNC6=CC=CC=C65)C(=NC(CCCCN)C(=NC(CC7=CN=CN7)C(=NC(CC(=N)O)C(=NC(C(C)CC)C(=NC(C(C)O)C(=NC(CCC(=N)O)C(=O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)N=C(C(CCCCN)N=C(C(CC(=O)O)N=C(C(CCSC)N=C(C(C)N=C(C(C(C)CC)N=C(C(CO)N=C(C(CC8=CC=C(C=C8)O)N=C(C(CC(=O)O)N=C(C(CO)N=C(C(C(C)CC)N=C(C(CC9=CC=CC=C9)N=C(C(C(C)O)N=C(CN=C(C(CCC(=O)O)N=C(C(C)N=C(C(CC1=CC=C(C=C1)O)N)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O
Canonical SMILES
CCC(C)C(N=C(O)C(CO)N=C(O)C(Cc1ccc(O)cc1)N=C(O)C(CC(=O)O)N=C(O)C(CO)N=C(O)C(N=C(O)C(Cc1ccccc1)N=C(O)C(N=C(O)CN=C(O)C(CCC(=O)O)N=C(O)C(C)N=C(O)C(N)Cc1ccc(O)cc1)C(C)O)C(C)CC)C(O)=NC(C)C(O)=NC(CCSC)C(O)=NC(CC(=O)O)C(O)=NC(CCCCN)C(O)=NC(C(O)=NC(Cc1cnc[nH]1)C(O)=NC(CCC(=N)O)C(O)=NC(CCC(=N)O)C(O)=NC(CC(=O)O)C(O)=NC(Cc1ccccc1)C(O)=NC(C(O)=NC(CC(=N)O)C(O)=NC(Cc1c[nH]c2ccccc12)C(O)=NC(CC(C)C)C(O)=NC(CC(C)C)C(O)=NC(C)C(O)=NC(CCC(=N)O)C(O)=NC(CCCCN)C(O)=NCC(O)=NC(CCCCN)C(O)=NC(CCCCN)C(O)=NC(CC(=N)O)C(O)=NC(CC(=O)O)C(O)=NC(Cc1c[nH]c2ccccc12)C(O)=NC(CCCCN)C(O)=NC(Cc1cnc[nH]1)C(O)=NC(CC(=N)O)C(O)=NC(C(O)=NC(C(O)=NC(CCC(=N)O)C(=O)O)C(C)O)C(C)CC)C(C)C)C(C)CC

Names & Synonyms

  • C226H338N60O66S
  • 100040-31-1
  • 5-amino-2-[[2-[[2-[[4-amino-2-[[2-[[6-amino-2-[[2-[[2-[[4-amino-2-[[6-amino-2-[[6-amino-2-[[2-[[6-amino-2-[[5-amino-2-[2-[[2-[[2-[[2-[[4-amino-2-[[2-[[2-[[2-[[5-amino-2-[[5-amino-2-[[2-[[2-[[6-amino-2-[[2-[[2-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoylamino]-4-carboxy-butanoyl]amino]acetyl]amino]-3-hydroxy-butanoyl]amino]-3-phenyl-propanoyl]amino]-3-methyl-pentanoyl]amino]-3-hydroxy-propanoyl]amino]-3-carboxy-propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxy-propanoyl]amino]-3-methyl-pentanoyl]amino]propanoylamino]-4-methylsulfanyl-butanoyl]amino]-3-carboxy-propanoyl]amino]hexanoyl]amino]-3-methyl-pentanoyl]amino]-3-(1H-imidazol-4-yl)propanoyl]amino]-5-oxo-pentanoyl]amino]-5-oxo-pentanoyl]amino]-3-carboxy-propanoyl]amino]-3-phenyl-propanoyl]amino]-3-methyl-butanoyl]amino]-4-oxo-butanoyl]amino]-3-(1H-indol-3-yl)propanoy