Basic information
- Standard SMILES
COc1ccc(C(=O)c2c(C(=O)O)ccc(OC)c2OC)c(OC)c1OC- InChIKey
DWRHZASBSZESOF-UHFFFAOYSA-N- Molecular formula
- C19H20O8
- Average molar mass
- 376.4 g/mol
- Monoisotopic mass
- 376.11581759
Names & identifiers
- Preferred name
- 4,5-Dimethoxy-6-(2,3,4-trimethoxybenzoyl)benzoic acid
- IUPAC
- 3,4-dimethoxy-2-(2,3,4-trimethoxybenzoyl)benzoic acid
Names & synonyms
SCHEMBL7376098DWRHZASBSZESOF-UHFFFAOYSA-N4,5-dimethoxy-6-(2,3,4-trimethoxybenzoyl)benzoic acid
Database identifiers
- PubChem CID
- 18399002
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 510
Related reactions
1 records
Compound notes
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