Pentostatin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 114
Total Number of Articles : 323
PubChem 439693
Molecular Formula

C11H16N4O4

SMILES

C1[C@@H]([C@H](O[C@H]1N2C=NC3=C2NC=NC[C@H]3O)CO)O

InChI

InChI=1S/C11H16N4O4/c16-3-8-6(17)1-9(19-8)15-5-14-10-7(18)2-12-4-13-11(10)15/h4-9,16-18H,1-3H2,(H,12,13)/t6-,7+,8+,9+/m0/s1

synonyms
  • pentostatin
  • Deoxycoformycin
  • Nipent
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Properties
Property Value
MW 268.27 g/mol
HBD 4
HBA 6
Rotatable Bond Count 2
Exact Mass 268.11715500 g/mol
Monoisotopic Mass 268.11715500 g/mol
Heavy Atom Count 19
Isotope Atom Count 0
Atom Stereo Count 4
Covalent Unit Count 1
Complexity 356
xlogp -2.1
Topological Polar Surface Area 112