Basic information
- Standard SMILES
COc1ccc(CCC2(C3CCCC3)CC(=O)C(C(=O)Cc3ccccc3)C(=O)O2)c(OC)c1- InChIKey
ZRYOWQFWFPKVGH-UHFFFAOYSA-N- Molecular formula
- C28H32O6
- Average molar mass
- 464.5 g/mol
Names & identifiers
- Preferred name
- 6-Cyclopentyl-6-[2-(2,4-dimethoxyphenyl)ethyl]-3-(2-phenylacetyl)tetrahydropyran-2,4-dione
- IUPAC
- 6-cyclopentyl-6-[2-(2,4-dimethoxyphenyl)ethyl]-3-(2-phenylacetyl)oxane-2,4-dione
Names & synonyms
SCHEMBL58807976-cyclopentyl-6-[2-(2,4-dimethoxyphenyl)ethyl]-3-(2-phenylacetyl)tetrahydropyran-2,4-dione2H-Pyran-2,4(3H)-dione, 6-cyclopentyl-6-[2-(2,4-dimethoxyphenyl)ethyl]dihydro-3-(phenylacetyl)-
Database identifiers
- PubChem CID
- 16728841
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 722
Related reactions
1 records
Compound notes
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