2-Hydroxy-3,4,6,9-tetramethoxydibenzofuran

Details

• Internal ID: 51ed565a-90e0-4a95-b01e-0f1d2c9091ac
• Taxonomy: Organoheterocyclic compounds > Benzofurans > Dibenzofurans
• IUPAC Name: 3,4,6,9-tetramethoxydibenzofuran-2-ol
• SMILES (Canonical): COC1=C2C3=CC(=C(C(=C3OC2=C(C=C1)OC)OC)OC)O
• SMILES (Isomeric): COC1=C2C3=CC(=C(C(=C3OC2=C(C=C1)OC)OC)OC)O
• InChI: InChI=1S/C16H16O6/c1-18-10-5-6-11(19-2)15-12(10)8-7-9(17)14(20-3)16(21-4)13(8)22-15/h5-7,17H,1-4H3
• InChI Key: UKLAPCYGHOYTBR-UHFFFAOYSA-N
• Popularity: 1 reference in papers

Physical and Chemical Properties

• Molecular Formula: C₁₆H₁₆O₆
• Molecular Weight: 304.29 g/mol
• Exact Mass: 304.09468823 g/mol
• Topological Polar Surface Area (TPSA): 70.30 Ų
• XlogP: 3.20

Synonyms

• CHEMBL1270045
• 2-Hydroxy-3,4,6,9-tetramethoxydibenzofuran
• Q27138962

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	97.24%	91.11%
CHEMBL2635	P51452	Dual specificity protein phosphatase 3	92.73%	94.00%
CHEMBL4203	Q9HAZ1	Dual specificity protein kinase CLK4	90.70%	94.45%
CHEMBL2535	P11166	Glucose transporter	87.56%	98.75%
CHEMBL3108638	O15164	Transcription intermediary factor 1-alpha	86.67%	95.56%
CHEMBL3194	P02766	Transthyretin	86.42%	90.71%
CHEMBL1806	P11388	DNA topoisomerase II alpha	85.51%	89.00%
CHEMBL1255126	O15151	Protein Mdm4	84.33%	90.20%
CHEMBL3060	Q9Y345	Glycine transporter 2	83.77%	99.17%
CHEMBL1293249	Q13887	Kruppel-like factor 5	83.73%	86.33%
CHEMBL1163101	O75460	Serine/threonine-protein kinase/endoribonuclease IRE1	81.27%	98.11%
CHEMBL3192	Q9BY41	Histone deacetylase 8	81.01%	93.99%

Plants that contains it

• Rhaphiolepis indica

Cross-Links

• PubChem: 49831388
• LOTUS: LTS0204683
• wikiData: Q27138962