carfilzomib

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 211
Total Number of Articles : 167
PubChem 11556711
Molecular Formula

C40H57N5O7

SMILES

CC(C)C[C@@H](C(=O)[C@]1(CO1)C)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC3=CC=CC=C3)NC(=O)CN4CCOCC4

InChI

InChI=1S/C40H57N5O7/c1-27(2)22-32(36(47)40(5)26-52-40)42-39(50)34(24-30-14-10-7-11-15-30)44-38(49)33(23-28(3)4)43-37(48)31(17-16-29-12-8-6-9-13-29)41-35(46)25-45-18-20-51-21-19-45/h6-15,27-28,31-34H,16-26H2,1-5H3,(H,41,46)(H,42,50)(H,43,48)(H,44,49)/t31-,32-,33-,34-,40+/m0/s1

synonyms
  • Carfilzomib
  • 868540-17-4
  • UNII-72X6E3J5AR
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Properties
Property Value
MW 719.9 g/mol
HBD 4
HBA 8
Rotatable Bond Count 20
Exact Mass 719.42579917 g/mol
Monoisotopic Mass 719.42579917 g/mol
Heavy Atom Count 52
Isotope Atom Count 0
Atom Stereo Count 5
Covalent Unit Count 1
Complexity 1180
xlogp 4.7
Topological Polar Surface Area 158