Chemical Compound

acetic acid;N-[1-[[1-[[2-[[3-amino-1-[[4-amino-1-[[2-[[2-[[1-[[2-[[2-[[1-[(1-carbamoyl-3-methylsulfanyl-propyl)carbamoyl]-3-methyl-butyl]amino]-1-(1H-imidazol-5-ylmethyl)-2-oxo-ethyl]amino]-2-oxo-ethyl]carbamoyl]-2-methyl-propyl]amino]-1-methyl-2-oxo-ethyl]amino]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]carbamoyl]-4-oxo-butyl]carbamoyl]-3-oxo-propyl]amino]-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]carbamoyl]-4-guanidino-butyl]-2-[(5-oxopyrrolidine-2-carbonyl)amino]pentanediamide

CAS Registry Number 31362-50-2
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acetic acid;N-[1-[[1-[[2-[[3-amino-1-[[4-amino-1-[[2-[[2-[[1-[[2-[[2-[[1-[(1-carbamoyl-3-methylsulfanyl-propyl)carbamoyl]-3-methyl-butyl]amino]-1-(1H-imidazol-5-ylmethyl)-2-oxo-ethyl]amino]-2-oxo-ethyl]carbamoyl]-2-methyl-propyl]amino]-1-methyl-2-oxo-ethyl]amino]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]carbamoyl]-4-oxo-butyl]carbamoyl]-3-oxo-propyl]amino]-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]carbamoyl]-4-guanidino-butyl]-2-[(5-oxopyrrolidine-2-carbonyl)amino]pentanediamide 结构式
Primary record

acetic acid;N-[1-[[1-[[2-[[3-amino-1-[[4-amino-1-[[2-[[2-[[1-[[2-[[2-[[1-[(1-carbamoyl-3-methylsulfanyl-propyl)carbamoyl]-3-methyl-butyl]amino]-1-(1H-imidazol-5-ylmethyl)-2-oxo-ethyl]amino]-2-oxo-ethyl]carbamoyl]-2-methyl-propyl]amino]-1-methyl-2-oxo-ethyl]amino]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]carbamoyl]-4-oxo-butyl]carbamoyl]-3-oxo-propyl]amino]-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]carbamoyl]-4-guanidino-butyl]-2-[(5-oxopyrrolidine-2-carbonyl)amino]pentanediamide

库存
1,202 克
纯度
98.5 %
CAS
31362-50-2

化合物标识与属性

CAS
31362-50-2
PubChem CID
176447242
SMILES
CC(C)CC(C(=NCC(=NC(CC(=N)O)C(=NC(CCC(=N)O)C(=NC(CC1=CNC2=CC=CC=C21)C(=NC(C)C(=NC(C(C)C)C(=NCC(=NC(CC3=CN=CN3)C(=NC(CC(C)C)C(=NC(CCSC)C(=N)O)O)O)O)O)O)O)O)O)O)O)N=C(C(CCCNC(=N)N)N=C(C(CCC(=N)O)N=C(C4CCC(=N4)O)O)O)O.CC(=O)O
Canonical SMILES
CC(=O)O.CSCCC(N=C(O)C(CC(C)C)N=C(O)C(Cc1cnc[nH]1)N=C(O)CN=C(O)C(N=C(O)C(C)N=C(O)C(Cc1c[nH]c2ccccc12)N=C(O)C(CCC(=N)O)N=C(O)C(CC(=N)O)N=C(O)CN=C(O)C(CC(C)C)N=C(O)C(CCCNC(=N)N)N=C(O)C(CCC(=N)O)N=C(O)C1CCC(O)=N1)C(C)C)C(=N)O

名称与同义词

  • C73H114N24O20S
  • 31362-50-2
  • acetic acid;N-[1-[[1-[[2-[[3-amino-1-[[4-amino-1-[[2-[[2-[[1-[[2-[[2-[[1-[(1-carbamoyl-3-methylsulfanyl-propyl)carbamoyl]-3-methyl-butyl]amino]-1-(1H-imidazol-5-ylmethyl)-2-oxo-ethyl]amino]-2-oxo-ethyl]carbamoyl]-2-methyl-propyl]amino]-1-methyl-2-oxo-ethyl]amino]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]carbamoyl]-4-oxo-butyl]carbamoyl]-3-oxo-propyl]amino]-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]carbamoyl]-4-guanidino-butyl]-2-[(5-oxopyrrolidine-2-carbonyl)amino]pentanediamide