Pancuronium

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 25
Total Number of Articles : 49
PubChem 441289
Molecular Formula

C35H60N2O4+2

SMILES

CC(=O)O[C@H]1C[C@@H]2CC[C@@H]3[C@@H]([C@]2(C[C@@H]1[N+]4(CCCCC4)C)C)CC[C@]5([C@H]3C[C@@H]([C@@H]5OC(=O)C)[N+]6(CCCCC6)C)C

InChI

InChI=1S/C35H60N2O4/c1-24(38)40-32-21-26-13-14-27-28(35(26,4)23-31(32)37(6)19-11-8-12-20-37)15-16-34(3)29(27)22-30(33(34)41-25(2)39)36(5)17-9-7-10-18-36/h26-33H,7-23H2,1-6H3/q+2/t26-,27+,28-,29-,30-,31-,32-,33-,34-,35-/m0/s1

synonyms
  • pancuronium
  • Pavulon
  • Pancuronium dibromide
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Properties
Property Value
MW 572.9 g/mol
HBD 0
HBA 4
Rotatable Bond Count 6
Exact Mass 572.45530840 g/mol
Monoisotopic Mass 572.45530840 g/mol
Heavy Atom Count 41
Isotope Atom Count 0
Atom Stereo Count 10
Covalent Unit Count 1
Complexity 1000
xlogp 6.6
Topological Polar Surface Area 52.6