Zearalenone
From DrugPedia: A Wikipedia for Drug discovery
|
Contents |
Description
(S-(E))-3,4,5,6,8,10-Hexahydro-14,16-dihydroxy-3-methyl-1H-2-benzoxacy clotetradecin-1,7(8H)-dione. One of a group of compounds known under the general designation of resorcylic acid lactones. Cis, trans, dextro and levo forms have been isolated from the fungus Gibberella zeae (formerly Fusarium graminearum). They have estrogenic activity, cause toxicity in livestock as feed contaminant, and have been used as anabolic or estrogen substitutes.
General Properties
*Molecular Weight
318.36
*Molecular Formula
C18H22O5
*IUPAC NAME
(4S,12E)-15,17-dihydroxy-4-methyl-3-oxabicyclo[12.4.0]octadeca-1(14),12,15,17-tetraene-2,8-dione
*Canonical Smiles
CC1CCCC(=O)CCCC=CC2=C(C=C(C=C2C(=O)O1)O)O
*Isomeric Smiles
C[C@H]1CCCC(=O)CCCC=CC2=C(C=C(C=C2C(=O)O1)O)O
PhysioChemical Properties
*Melting Point
164.5(EXP)
*LogP
3.58(EST)
*Water Solubility
External Links
- [1]Pubchem