Chemical Compound

C84H112ClN17O16

CAS Registry Number 625092-10-6
C84H112ClN17O16 chemical structure
Primary Record

C84H112ClN17O16

In stock
6,202 g
Purity
98.1 %
CAS
625092-10-6

Compound Identifiers & Properties

CAS
625092-10-6
PubChem CID
176446999
SMILES
C[C@H](C(=N)O)N=C([C@@H]1CCCN1C(=O)[C@H](CCCCNC(C)C)N=C([C@H](CC(C)C)N=C([C@@H](CCCCN=C(C2=CN=CC=C2)O)N=C([C@H](CCCCN=C(C3=CN=CC=C3)O)N=C([C@H](CO)N=C([C@@H](CC4=CN=CC=C4)N=C([C@@H](CC5=CC=C(C=C5)Cl)N=C([C@@H](CC6=CC7=CC=CC=C7C=C6)N=C(C)O)O)O)O)O)O)O)O)O.CC(=O)O
Canonical SMILES
CC(=O)O.CC(O)=N[C@H](Cc1ccc2ccccc2c1)C(O)=N[C@H](Cc1ccc(Cl)cc1)C(O)=N[C@H](Cc1cccnc1)C(O)=N[C@@H](CO)C(O)=N[C@@H](CCCCN=C(O)c1cccnc1)C(O)=N[C@H](CCCCN=C(O)c1cccnc1)C(O)=N[C@@H](CC(C)C)C(O)=N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(O)=N[C@H](C)C(=N)O

Names & Synonyms

  • C84H112ClN17O16
  • MFCD32666104
  • 625092-10-6
  • N-[(5R)-5-[[(2S)-2-[[(2S)-2-[[(2R)-2-[[(2R)-2-[[(2R)-2-acetamido-3-(2-naphthyl)propanoyl]amino]-3-(4-chlorophenyl)propanoyl]amino]-3-(3-pyridyl)propanoyl]amino]-3-hydroxy-propanoyl]amino]-6-(pyridine-3-carbonylamino)hexanoyl]amino]-6-[[(1S)-1-[[(1S)-1-[(2S)-2-[[(1R)-2-amino-1-methyl-2-oxo-ethyl]carbamoyl]pyrrolidine-1-carbonyl]-5-(isopropylamino)pentyl]carbamoyl]-3-methyl-butyl]amino]-6-oxo-hexyl]pyridine-3-carboxamide;acetic acid