Molecular Identity
isoformononetin
3-(4-hydroxyphenyl)-7-methoxychromen-4-one
PubChem CID: 3764
Isoformononetin is a methoxyisoflavone that is isoflavone substituted at positions 4' and 7 by hydroxy and methoxy groups respectively. It has a role as a metabolite, a bone density conservation agent and an apoptosis inhibitor. It is a member of 7-methoxyisoflavones and a hydroxyisoflavone. It is functionally related to a daidzein.
2D Structure
Properties
C16H12O4
Molecular Formula
268.26
Molecular Weight
g/mol
268.0736
Exact Mass
Da
2.8
XLogP
Drug-like (Lipinski: < 5)
55.8
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
4
H-Bond Acceptors
395
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
isoformononetin486-63-54'-HYDROXY-7-METHOXYISOFLAVONE3-(4-hydroxyphenyl)-7-methoxychromen-4-oneCHEBI:29608DTXSID40274405RefChem:923699DTXCID702258843-(4-Hydroxyphenyl)-7-methoxy-4H-chromen-4-oneISOFORMONENTIN4''-HYDROXY-7-METHOXYISOFLAVONEMFCD001008384H-1-Benzopyran-4-one, 3-(4-hydroxyphenyl)-7-methoxy-7-methoxy-4'-hydroxyisoflavone3-(4-Hydroxyphenyl)-7-methoxy-4H-1-benzopyran-4-one
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to isoformononetin
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