Rutin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 438
Total Number of Articles : 455
PubChem 5280805
Molecular Formula

C27H30O16

SMILES

C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O

InChI

InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1

synonyms
  • RUTIN
  • 153-18-4
  • rutoside
Click to show/hide the synonyms
Properties
Property Value
MW 610.5 g/mol
HBD 10
HBA 16
Rotatable Bond Count 6
Exact Mass 610.15338487 g/mol
Monoisotopic Mass 610.15338487 g/mol
Heavy Atom Count 43
Isotope Atom Count 0
Atom Stereo Count 10
Covalent Unit Count 1
Complexity 1020
xlogp -1.3
Topological Polar Surface Area 266