4H-1-Benzopyran-4-one, 2-(3,5-dihydroxyphenyl)-5,7-dihydroxy-
Basic information
- CAS
74805-73-5- Standard SMILES
O=c1cc(-c2cc(O)cc(O)c2)oc2cc(O)cc(O)c12- InChIKey
LRDGATPGVJTWLJ-UHFFFAOYSA-N- Molecular formula
- C15H10O6
- Average molar mass
- 286.24 g/mol
- Monoisotopic mass
- 286.04773803
Overview
4H-1-Benzopyran-4-one, 2-(3,5-dihydroxyphenyl)-5,7-dihydroxy- has been reported in Inula salsoloides and Entada phaseoloides with data available.
Names & identifiers
- Preferred name
- 4H-1-Benzopyran-4-one, 2-(3,5-dihydroxyphenyl)-5,7-dihydroxy-
- IUPAC
- 2-(3,5-dihydroxyphenyl)-5,7-dihydroxychromen-4-one
Names & synonyms
74805-73-52-(3,5-Dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one4H-1-Benzopyran-4-one, 2-(3,5-dihydroxyphenyl)-5,7-dihydroxy-DTXSID80225779RefChem:100675DTXCID60148270SCHEMBL326796575,7,3',5'-Tetrahydroxyflavone
Database identifiers
- CAS
74805-73-5- PubChem CID
- 5487757
- DTXSID
DTXSID80225779- Nikkaji
- J2.075.949F
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 437
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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