Zuccagin

Details

• Internal ID: c8d408f9-434c-487f-b1e3-0c6b88663fa9
• Taxonomy: Phenylpropanoids and polyketides > Flavonoids > Flavones > Flavonols
• IUPAC Name: 3,7-dihydroxy-8-methoxy-2-phenylchromen-4-one
• InChI: InChI=1S/C16H12O5/c1-20-16-11(17)8-7-10-12(18)13(19)14(21-15(10)16)9-5-3-2-4-6-9/h2-8,17,19H,1H3
• InChI Key: GFZSBWIGTNTNKS-UHFFFAOYSA-N
• Popularity: 3 references in papers

Physical and Chemical Properties

• Molecular Formula: C₁₆H₁₂O₅
• Molecular Weight: 284.26 g/mol
• Exact Mass: 284.06847348 g/mol
• Topological Polar Surface Area (TPSA): 76.00 Ų
• XlogP: 2.70

Synonyms

• 3,7-dihydroxy-8-methoxyflavone
• LMPK12111600

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
CHEMBL5619	P27695	DNA-(apurinic or apyrimidinic site) lyase	99.51%	91.11%
CHEMBL3108638	O15164	Transcription intermediary factor 1-alpha	95.94%	95.56%
CHEMBL3038477	P67870	Casein kinase II alpha/beta	94.03%	99.23%
CHEMBL2581	P07339	Cathepsin D	92.61%	98.95%
CHEMBL1860	P10827	Thyroid hormone receptor alpha	91.95%	99.15%
CHEMBL1293249	Q13887	Kruppel-like factor 5	89.91%	86.33%
CHEMBL2635	P51452	Dual specificity protein phosphatase 3	88.73%	94.00%
CHEMBL1806	P11388	DNA topoisomerase II alpha	88.51%	89.00%
CHEMBL3091268	Q92753	Nuclear receptor ROR-beta	88.51%	95.50%
CHEMBL2085	P14174	Macrophage migration inhibitory factor	82.98%	80.78%
CHEMBL1821	P08173	Muscarinic acetylcholine receptor M4	80.25%	94.08%

Plants that contains it

• Zuccagnia punctata

Cross-Links

• PubChem: 14079475
• LOTUS: LTS0230895
• wikiData: Q105007913