2,3-Dihydroflavon-3-ol

Details

• Internal ID: ba0f3d82-4daf-40f8-a6e2-bba387de170a
• Taxonomy: Phenylpropanoids and polyketides > Flavonoids > Flavans > Flavanones > Flavanonols
• IUPAC Name: 3-hydroxy-2-phenyl-2,3-dihydrochromen-4-one
• SMILES (Canonical): C1=CC=C(C=C1)C2C(C(=O)C3=CC=CC=C3O2)O
• SMILES (Isomeric): C1=CC=C(C=C1)C2C(C(=O)C3=CC=CC=C3O2)O
• InChI: InChI=1S/C15H12O3/c16-13-11-8-4-5-9-12(11)18-15(14(13)17)10-6-2-1-3-7-10/h1-9,14-15,17H
• InChI Key: YEDFEBOUHSBQBT-UHFFFAOYSA-N
• Popularity: 1,519 references in papers

Physical and Chemical Properties

• Molecular Formula: C₁₅H₁₂O₃
• Molecular Weight: 240.25 g/mol
• Exact Mass: 240.078644241 g/mol
• Topological Polar Surface Area (TPSA): 46.50 Ų
• XlogP: 2.40

Synonyms

• 3-hydroxy-2-phenylchroman-4-one
• 2,3-dihydroflavon-3-ol
• Dihydroflavonol
• 3-hydroxy-2-phenyl-2,3-dihydrochromen-4-one
• 4H-1-Benzopyran-4-one, 2,3-dihydro-3-hydroxy-2-phenyl-
• 3-Hydroxy-2-phenyl-2,3-dihydro-4H-chromen-4-one
• 124191-32-8
• dihydroflavonols
• Flavanon-3-ol
• 2,3-dihydroflavonols
• Maybridge3_002930
• SCHEMBL130234
• 4H-1-Benzopyran-4-one, 2,3-dihydrohydroxy-2-phenyl-
• CHEBI:48039
• CHEBI:48040
• DTXSID90924746
• YEDFEBOUHSBQBT-UHFFFAOYSA-N
• HMS1439F04
• 3-hydroxy-2-phenyl-chroman-4-one
• AKOS002177399
• AKOS016295991
• IDI1_014317
• NCGC00178229-01
• NCGC00178229-02
• AS-69760
• F87154
• A882990
• J-009899
• 3-Hydroxy-2-phenyl-2,3-dihydro-4H-chromen-4-one #
• Q27120915
• 3-Hydroxy-2-phenyl-2,3-dihydro-4H-1-benzopyran-4-one
• 3-hydroxy-2-phenyl-3,4-dihydro-2H-1-benzopyran-4-one

2D Structure

ADMET Properties (via admetSAR 2)

Target	Value	Probability (raw)	Probability (%)
No predicted properties yet!

Targets

Proven Targets:

No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID	UniProt ID	Name	Probability	Model accuracy
CHEMBL1951	P21397	Monoamine oxidase A	97.52%	91.49%
CHEMBL3108638	O15164	Transcription intermediary factor 1-alpha	92.23%	95.56%
CHEMBL2581	P07339	Cathepsin D	90.78%	98.95%
CHEMBL3038477	P67870	Casein kinase II alpha/beta	88.05%	99.23%
CHEMBL5619	P27695	DNA-(apurinic or apyrimidinic site) lyase	83.33%	91.11%
CHEMBL1806	P11388	DNA topoisomerase II alpha	82.36%	89.00%
CHEMBL1293249	Q13887	Kruppel-like factor 5	81.03%	86.33%
CHEMBL3475	P05121	Plasminogen activator inhibitor-1	80.59%	83.00%

Plants that contains it

• Acacia floribunda
• Astragalus mongholicus
• Dianthus caryophyllus
• Hovenia dulcis

Cross-Links

• PubChem: 147806
• LOTUS: LTS0109995
• wikiData: Q27120915