Tubocurarine

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 104
Total Number of Articles : 155
PubChem 6000
Molecular Formula

C37H41N2O6+

SMILES

CN1CCC2=CC(=C3C=C2[C@@H]1CC4=CC=C(C=C4)OC5=C6[C@@H](CC7=CC(=C(C=C7)O)O3)[N+](CCC6=CC(=C5O)OC)(C)C)OC

InChI

InChI=1S/C37H40N2O6/c1-38-14-12-24-19-32(42-4)33-21-27(24)28(38)16-22-6-9-26(10-7-22)44-37-35-25(20-34(43-5)36(37)41)13-15-39(2,3)29(35)17-23-8-11-30(40)31(18-23)45-33/h6-11,18-21,28-29H,12-17H2,1-5H3,(H-,40,41)/p+1/t28-,29+/m0/s1

synonyms
  • tubocurarine
  • d-Tubocurarine
  • Tubocurarine chloride
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Properties
Property Value
MW 609.7 g/mol
HBD 2
HBA 7
Rotatable Bond Count 2
Exact Mass 609.29646203 g/mol
Monoisotopic Mass 609.29646203 g/mol
Heavy Atom Count 45
Isotope Atom Count 0
Atom Stereo Count 2
Covalent Unit Count 1
Complexity 990
xlogp 6
Topological Polar Surface Area 80.6