Chemical Compound

5-[[4-amino-1-[[1-[[2-[[4-amino-1-[[18-[[3-amino-1-[[1-[[5-amino-1-[[1-[1-[[1-[[1-[(1-carbamoyl-2-methyl-butyl)carbamoyl]-2-methyl-butyl]carbamoyl]-3-carboxy-propyl]carbamoyl]pentylcarbamoyl]-3-methyl-butyl]carbamoyl]pentyl]carbamoyl]-4-guanidino-butyl]carbamoyl]-3-oxo-propyl]carbamoyl]-3-(1H-imidazol-4-ylmethyl)-6-methyl-2,5,8,12-tetraoxo-1,4,7,13-tetrazacyclooctadec-9-yl]carbamoyl]-4-oxo-butyl]amino]-1-methyl-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]carbamoyl]-4-oxo-butyl]amino]-4-[2-[[2-[2-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-3-phenyl-propanoyl)amino]-3-(1H-imidazol-4-yl)propanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-5-guanidino-pentanoyl]amino]-4-carboxy-butanoyl]amino]-3-methyl-butanoyl]amino]-4-methyl-pentanoyl]amino]-4-carboxy-butanoyl]amino]hexanoylamino]propanoylamino]-5-guanidino-pentanoyl]amino]propanoylamino]-5-oxo-pentanoic acid

CAS Registry Number 170809-51-5
5-[[4-amino-1-[[1-[[2-[[4-amino-1-[[18-[[3-amino-1-[[1-[[5-amino-1-[[1-[1-[[1-[[1-[(1-carbamoyl-2-methyl-butyl)carbamoyl]-2-methyl-butyl]carbamoyl]-3-carboxy-propyl]carbamoyl]pentylcarbamoyl]-3-methyl-butyl]carbamoyl]pentyl]carbamoyl]-4-guanidino-butyl]carbamoyl]-3-oxo-propyl]carbamoyl]-3-(1H-imidazol-4-ylmethyl)-6-methyl-2,5,8,12-tetraoxo-1,4,7,13-tetrazacyclooctadec-9-yl]carbamoyl]-4-oxo-butyl]amino]-1-methyl-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]carbamoyl]-4-oxo-butyl]amino]-4-[2-[[2-[2-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-3-phenyl-propanoyl)amino]-3-(1H-imidazol-4-yl)propanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-5-guanidino-pentanoyl]amino]-4-carboxy-butanoyl]amino]-3-methyl-butanoyl]amino]-4-methyl-pentanoyl]amino]-4-carboxy-butanoyl]amino]hexanoylamino]propanoylamino]-5-guanidino-pentanoyl]amino]propanoylamino]-5-oxo-pentanoic acid 结构式
Primary record

5-[[4-amino-1-[[1-[[2-[[4-amino-1-[[18-[[3-amino-1-[[1-[[5-amino-1-[[1-[1-[[1-[[1-[(1-carbamoyl-2-methyl-butyl)carbamoyl]-2-methyl-butyl]carbamoyl]-3-carboxy-propyl]carbamoyl]pentylcarbamoyl]-3-methyl-butyl]carbamoyl]pentyl]carbamoyl]-4-guanidino-butyl]carbamoyl]-3-oxo-propyl]carbamoyl]-3-(1H-imidazol-4-ylmethyl)-6-methyl-2,5,8,12-tetraoxo-1,4,7,13-tetrazacyclooctadec-9-yl]carbamoyl]-4-oxo-butyl]amino]-1-methyl-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]carbamoyl]-4-oxo-butyl]amino]-4-[2-[[2-[2-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-3-phenyl-propanoyl)amino]-3-(1H-imidazol-4-yl)propanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-5-guanidino-pentanoyl]amino]-4-carboxy-butanoyl]amino]-3-methyl-butanoyl]amino]-4-methyl-pentanoyl]amino]-4-carboxy-butanoyl]amino]hexanoylamino]propanoylamino]-5-guanidino-pentanoyl]amino]propanoylamino]-5-oxo-pentanoic acid

库存
1,733 克
纯度
98.5 %
CAS
170809-51-5

化合物标识与属性

CAS
170809-51-5
PubChem CID
176446436
SMILES
CCCCC(C(=NC(C)C(=NC(CCCNC(=N)N)C(=NC(C)C(=NC(CCC(=O)O)C(=NC(CCC(=N)O)C(=NC(CC(C)C)C(=NC(C)C(=NC(CCC(=N)O)C(=NC1CCC(=NCCCCC(N=C(C(N=C(C(N=C1O)C)O)CC2=CN=CN2)O)C(=NC(CC(=N)O)C(=NC(CCCNC(=N)N)C(=NC(CCCCN)C(=NC(CC(C)C)C(=NC(CCCC)C(=NC(CCC(=O)O)C(=NC(C(C)CC)C(=NC(C(C)CC)C(=N)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)N=C(C(CCC(=O)O)N=C(C(CC(C)C)N=C(C(C(C)C)N=C(C(CCC(=O)O)N=C(C(CCCNC(=N)N)N=C(C(CC(C)C)N=C(C(CC(C)C)N=C(C(CC3=CN=CN3)N=C(C(CC4=CC=CC=C4)N)O)O)O)O)O)O)O)O)O
Canonical SMILES
CCCCC(N=C(O)C(CCC(=O)O)N=C(O)C(CC(C)C)N=C(O)C(N=C(O)C(CCC(=O)O)N=C(O)C(CCCNC(=N)N)N=C(O)C(CC(C)C)N=C(O)C(CC(C)C)N=C(O)C(Cc1cnc[nH]1)N=C(O)C(N)Cc1ccccc1)C(C)C)C(O)=NC(C)C(O)=NC(CCCNC(=N)N)C(O)=NC(C)C(O)=NC(CCC(=O)O)C(O)=NC(CCC(=N)O)C(O)=NC(CC(C)C)C(O)=NC(C)C(O)=NC(CCC(=N)O)C(O)=NC1CCC(O)=NCCCCC(C(O)=NC(CC(=N)O)C(O)=NC(CCCNC(=N)N)C(O)=NC(CCCCN)C(O)=NC(CC(C)C)C(O)=NC(CCCC)C(O)=NC(CCC(=O)O)C(O)=NC(C(O)=NC(C(=N)O)C(C)CC)C(C)CC)N=C(O)C(Cc2cnc[nH]2)N=C(O)C(C)N=C1O

名称与同义词

  • MFCD00798715
  • C161H269N49O42
  • 170809-51-5
  • 5-[[4-amino-1-[[1-[[2-[[4-amino-1-[[18-[[3-amino-1-[[1-[[5-amino-1-[[1-[1-[[1-[[1-[(1-carbamoyl-2-methyl-butyl)carbamoyl]-2-methyl-butyl]carbamoyl]-3-carboxy-propyl]carbamoyl]pentylcarbamoyl]-3-methyl-butyl]carbamoyl]pentyl]carbamoyl]-4-guanidino-butyl]carbamoyl]-3-oxo-propyl]carbamoyl]-3-(1H-imidazol-4-ylmethyl)-6-methyl-2,5,8,12-tetraoxo-1,4,7,13-tetrazacyclooctadec-9-yl]carbamoyl]-4-oxo-butyl]amino]-1-methyl-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]carbamoyl]-4-oxo-butyl]amino]-4-[2-[[2-[2-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-3-phenyl-propanoyl)amino]-3-(1H-imidazol-4-yl)propanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-5-guanidino-pentanoyl]amino]-4-carboxy-butanoyl]amino]-3-methyl-butanoyl]amino]-4-methyl-pentanoyl]amino]-4-carboxy-butanoyl]amino]hexanoylamino]propanoylamino]-5-guanidino-pentanoyl]amino]propanoylamino]-5-oxo-pentanoic acid