Chemical Compound

MFCD00133086

CAS Registry Number 112173-49-6
MFCD00133086 chemical structure
Primary Record

MFCD00133086

In stock
4,424 g
Purity
99.4 %
CAS
112173-49-6

Compound Identifiers & Properties

CAS
112173-49-6
PubChem CID
175688016
SMILES
CCC(C)C(C(=NC(CC1=CC=CC=C1)C(=NC(CCCNC(=N)N)C(=NC(CCCNC(=N)N)C(=O)O)O)O)O)N=C(C(CO)N=C(C(CCC(=N)O)N=C(C(CC(=O)O)N=C(C(CC(C)C)N=C(C(CC2=CN=CN2)N=C(C(C(C)C)N=C(C3CCCN3C(=O)C(CC(C)C)N=C(CN=C(C(CC(=N)O)N=C(C(CCC(=O)O)N)O)O)O)O)O)O)O)O)O)O
Canonical SMILES
CCC(C)C(N=C(O)C(CO)N=C(O)C(CCC(=N)O)N=C(O)C(CC(=O)O)N=C(O)C(CC(C)C)N=C(O)C(Cc1cnc[nH]1)N=C(O)C(N=C(O)C1CCCN1C(=O)C(CC(C)C)N=C(O)CN=C(O)C(CC(=N)O)N=C(O)C(N)CCC(=O)O)C(C)C)C(O)=NC(Cc1ccccc1)C(O)=NC(CCCNC(=N)N)C(O)=NC(CCCNC(=N)N)C(=O)O

Names & Synonyms

  • MFCD00133086
  • C78H125N25O23
  • 112173-49-6
  • 4-amino-5-[[3-amino-1-[[2-[[1-[2-[[1-[[2-[[1-[[2-[[4-amino-1-[[2-[[1-[[1-benzyl-2-[[1-[(1-carboxy-4-guanidino-butyl)carbamoyl]-4-guanidino-butyl]amino]-2-oxo-ethyl]carbamoyl]-2-methyl-butyl]amino]-1-(hydroxymethyl)-2-oxo-ethyl]carbamoyl]-4-oxo-butyl]amino]-1-(carboxymethyl)-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]amino]-1-(1H-imidazol-5-ylmethyl)-2-oxo-ethyl]carbamoyl]-2-methyl-propyl]carbamoyl]pyrrolidine-1-carbonyl]-3-methyl-butyl]amino]-2-oxo-ethyl]carbamoyl]-3-oxo-propyl]amino]-5-oxo-pentanoic acid