benzyloxycarbonylvalyl-alanyl-aspartyl fluoromethyl ketone

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 544
Total Number of Articles : 1260
PubChem 137795041
Molecular Formula

C22H28FN3O8

SMILES

CC(C)C(C(=O)NC(C)C(=O)NC(CC(=O)O)C(=O)C(=O)CF)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C22H28FN3O8/c1-12(2)18(26-22(33)34-11-14-7-5-4-6-8-14)21(32)24-13(3)20(31)25-15(9-17(28)29)19(30)16(27)10-23/h4-8,12-13,15,18H,9-11H2,1-3H3,(H,24,32)(H,25,31)(H,26,33)(H,28,29)

synonyms
  • Benzyloxycarbonylvalyl-alanyl-aspartyl Fluoromethyl Ketone
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Properties
Property Value
MW 481.5 g/mol
HBD 4
HBA 9
Rotatable Bond Count 14
Exact Mass 481.18604302 g/mol
Monoisotopic Mass 481.18604302 g/mol
Heavy Atom Count 34
Isotope Atom Count 0
Atom Stereo Count 3
Covalent Unit Count 1
Complexity 767
xlogp 1.2
Topological Polar Surface Area 168