7-Hydroxy-5,6-Dimethoxyflavone
Basic information
- CAS
2035-05-4- Standard SMILES
COc1c(O)cc2oc(-c3ccccc3)cc(=O)c2c1OC- InChIKey
QMQAOYFHVBKQCG-UHFFFAOYSA-N- Molecular formula
- C17H14O5
- Average molar mass
- 298.29 g/mol
- Monoisotopic mass
- 298.08412354
Overview
7-hydroxy-5,6-dimethoxy-2-phenylchromen-4-one has been reported in Gomphrena martiana and Gomphrena boliviana with data available.
Names & identifiers
- Preferred name
- 7-Hydroxy-5,6-Dimethoxyflavone
- IUPAC
- 7-hydroxy-5,6-dimethoxy-2-phenylchromen-4-one
Names & synonyms
7-Hydroxy-5,6-DimethoxyflavoneBaicalein 5,6-dimethyl ether2035-05-4Baicalein dimethyl etherorb2893401SCHEMBL8064245CHEMBL2235247DTXSID804205054H-1-Benzopyran-4-one, 7-hydroxy-5,6-dimethoxy-2-phenyl-LMPK12111098TN86267-Hydroxy-5,6-dimethoxy-2-phenyl-chromen-4-one
Show more names
Q633990007-Hydroxy-5,6-dimethoxy-2-phenyl-4H-1-benzopyran-4-one
Database identifiers
- CAS
2035-05-4- PubChem CID
- 5481647
- DTXSID
DTXSID80420505- ChEMBL
CHEMBL2235247- Nikkaji
- J542.768A
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 65 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 440
Experimental & physicochemical properties
LipidsPolyketides [PK] -> Flavonoids [PK12] -> Flavones and Flavonols [PK1211]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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