Zearalenone

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 325
Total Number of Articles : 226
PubChem 5281576
Molecular Formula

C18H22O5

SMILES

C[C@H]1CCCC(=O)CCC/C=C/C2=C(C(=CC(=C2)O)O)C(=O)O1

InChI

InChI=1S/C18H22O5/c1-12-6-5-9-14(19)8-4-2-3-7-13-10-15(20)11-16(21)17(13)18(22)23-12/h3,7,10-12,20-21H,2,4-6,8-9H2,1H3/b7-3+/t12-/m0/s1

synonyms
  • ZEARALENONE
  • 17924-92-4
  • trans-Zearalenone
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Properties
Property Value
MW 318.4 g/mol
HBD 2
HBA 5
Rotatable Bond Count 0
Exact Mass 318.14672380 g/mol
Monoisotopic Mass 318.14672380 g/mol
Heavy Atom Count 23
Isotope Atom Count 0
Atom Stereo Count 1
Covalent Unit Count 1
Complexity 445
xlogp 3.6
Topological Polar Surface Area 83.8