Basic information
- Standard SMILES
CCOC(=O)[C@H](Cc1ccc(OC/C=C(\c2ccccc2)c2ccc(-c3ccco3)cc2)cc1)OCC- InChIKey
GSXHDRDHLCQMOC-GJKZIJEQSA-N- Molecular formula
- C32H32O5
- Average molar mass
- 496.6 g/mol
- Monoisotopic mass
- 496.22497412
Names & identifiers
- Preferred name
- (E)-(2S)-2-Ethoxy-3-{4-[3-(4-furan-2-yl-phenyl)-3-phenyl-allyloxy]-phenyl}-propionic acid ethyl ester
- IUPAC
- ethyl (2S)-2-ethoxy-3-[4-[(E)-3-[4-(furan-2-yl)phenyl]-3-phenylprop-2-enoxy]phenyl]propanoate
Names & synonyms
SCHEMBL6419783GSXHDRDHLCQMOC-GJKZIJEQSA-N(E)-(2S)-2-Ethoxy-3-{4-[3-(4-furan-2-yl-phenyl)-3-phenyl-allyloxy]-phenyl}-propionic acid ethyl ester
Database identifiers
- PubChem CID
- 69774285
Properties
Computed structural properties
- XLogP
- 7.4
- Topological polar surface area
- 57.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 13
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 683
Related reactions
1 records
Compound notes
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