Melatonin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 3133
Total Number of Articles : 5659
PubChem 896
Molecular Formula

C13H16N2O2

SMILES

CC(=O)NCCC1=CNC2=C1C=C(C=C2)OC

InChI

InChI=1S/C13H16N2O2/c1-9(16)14-6-5-10-8-15-13-4-3-11(17-2)7-12(10)13/h3-4,7-8,15H,5-6H2,1-2H3,(H,14,16)

synonyms
  • Melatonin
  • 73-31-4
  • Melatonine
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Properties
Property Value
MW 232.28 g/mol
HBD 2
HBA 2
Rotatable Bond Count 4
Exact Mass 232.121177757 g/mol
Monoisotopic Mass 232.121177757 g/mol
Heavy Atom Count 17
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 270
xlogp 0.8
Topological Polar Surface Area 54.1