justicidins

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 28
Total Number of Articles : 12
PubChem 159982
Molecular Formula

C22H18O7

SMILES

COC1=C(C=C2C(=C1)C(=C3C(=C2OC)COC3=O)C4=CC5=C(C=C4)OCO5)OC

InChI

InChI=1S/C22H18O7/c1-24-16-7-12-13(8-17(16)25-2)21(26-3)14-9-27-22(23)20(14)19(12)11-4-5-15-18(6-11)29-10-28-15/h4-8H,9-10H2,1-3H3

synonyms
  • Justicidin A
  • 25001-57-4
  • Justicidins
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Properties
Property Value
MW 394.4 g/mol
HBD 0
HBA 7
Rotatable Bond Count 4
Exact Mass 394.10525291 g/mol
Monoisotopic Mass 394.10525291 g/mol
Heavy Atom Count 29
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 612
xlogp 4
Topological Polar Surface Area 72.4