Ab-001
(1E,4E,6E)-1-(3,5-dimethoxyphenyl)-7-(4-hydroxy-3,5-dimethoxyphenyl)hepta-1,4,6-trien-3-one
Molecular Identity
Ab-001
(1E,4E,6E)-1-(3,5-dimethoxyphenyl)-7-(4-hydroxy-3,5-dimethoxyphenyl)hepta-1,4,6-trien-3-one
PubChem CID: 154728220
2D Structure
Properties
C23H24O6
Molecular Formula
396.40
Molecular Weight
g/mol
396.1573
Exact Mass
Da
4.3
XLogP
Drug-like (Lipinski: < 5)
74.2
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
6
H-Bond Acceptors
558
Complexity
SMILES
Canonical SMILES
SMILES: COC1=CC(=CC(=C1)C=CC(=O)C=CC=CC2=CC(=C(C(=C2)OC)O)OC)OCIsomeric SMILES
SMILES: COC1=CC(=CC(=C1)/C=C/C(=O)/C=C/C=C/C2=CC(=C(C(=C2)OC)O)OC)OCSynonyms(14)
TNM7KA4LB3AB0012663700-89-6RefChem:914882DTXCID8081313Ab-001DTXSID90158822UNII-TNM7KA4LB3(1E,4E,6E)-1-(3,5-Dimethoxyphenyl)-7-(4-hydroxy-3,5dimethoxyphenyl)hepta-1,4,6-trien-3-one1,4,6-Heptatrien-3-one, 1-(3,5-dimethoxyphenyl)-7-(4-hydroxy-3,5-dimethoxyphenyl)-, (1E,4E,6E)-CHEMBL5095207SCHEMBL26198778(1E, 4E, 6E)-1-(3, 5-dimethoxyphenyl)-7-(4-hydroxy-3, 5 dimethoxyphenyl) hepta-1, 4, 6-trien-3-one(1E,4E,6E)-1-(3,5-Dimethoxyphenyl)-7-(4-hydroxy-3,5-dimethoxyphenyl)hepta-1,4,6-trien-3-one
Data from PubChem (NCBI)
This platform is for informational purposes only and does not constitute medical advice. Always consult a qualified healthcare professional.
Drug Network
Trials and conditions connected to Ab-001
Loading drug network...