Basic information
- CAS
4431-47-4- Standard SMILES
COc1cc(O)c2c(=O)cc(-c3ccccc3)oc2c1O- InChIKey
CGTZOVPQCMHAIE-UHFFFAOYSA-N- Molecular formula
- C16H12O5
- Average molar mass
- 284.26 g/mol
- Monoisotopic mass
- 284.06847348
Overview
Pediflavone has been reported in Scutellaria strigillosa with data available.
Names & identifiers
- Preferred name
- 5,8-Dihydroxy-7-methoxy-2-phenyl-4H-1-benzopyran-4-one
- IUPAC
- 5,8-dihydroxy-7-methoxy-2-phenylchromen-4-one
- English name
- ISOWOGONIN
- Molecular weight
- 0
Names & synonyms
Pediflavone4431-47-4DTXSID301961275,8-Dihydroxy-7-methoxy-2-phenyl-4H-1-benzopyran-4-oneRefChem:1072279DTXCID40118618Isowogonin5,8-Dihydroxy-7-methoxyflavone5,8-dihydroxy-7-methoxy-2-phenyl-4H-chromen-4-one5,8-dihydroxy-7-methoxy-2-phenylchromen-4-oneBRN 02945144H-1-Benzopyran-4-one, 5,8-dihydroxy-7-methoxy-2-phenyl-
Show more names
FLAVONE, 5,8-DIHYDROXY-7-METHOXY-4-18-00-02675 (Beilstein Handbook Reference)CHEMBL2272376SCHEMBL28012275LMPK12111335NS00094669
Database identifiers
- CAS
4431-47-4- PubChem CID
- 20489
- DTXSID
DTXSID30196127- ChEMBL
CHEMBL2272376- Nikkaji
- J78.046D
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 76 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 426
Experimental & physicochemical properties
LipidsPolyketides [PK] -> Flavonoids [PK12] -> Flavones and Flavonols [PK1211]
Endocrine DisruptorsPotential endocrine disrupting compound
Chemistry & industry
Suppliers1 total
西安莱纳生物科技有限公司13289845288 13193362370 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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