Penizofuran A

Details

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Internal ID 004063d4-6125-44a6-9a26-fc24f9a46edd
Taxonomy Organoheterocyclic compounds > Benzofurans > Dibenzofurans
IUPAC Name 3,7,8-trimethoxy-1-methyldibenzofuran-2-ol
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C16H16O5/c1-8-15-9-5-11(18-2)12(19-3)6-10(9)21-13(15)7-14(20-4)16(8)17/h5-7,17H,1-4H3
InChI Key MEQFDBAJPLVSLC-UHFFFAOYSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C16H16O5
Molecular Weight 288.29 g/mol
Exact Mass 288.09977361 g/mol
Topological Polar Surface Area (TPSA) 61.10 Ų
XlogP 3.60

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of Penizofuran A

3D Structure

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ADMET Properties (via admetSAR 2)

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

Targets

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Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
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 96.77% 91.11%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 94.69% 94.00%
CHEMBL1806 P11388 DNA topoisomerase II alpha 89.16% 89.00%
CHEMBL241 Q14432 Phosphodiesterase 3A 87.19% 92.94%
CHEMBL225 P28335 Serotonin 2c (5-HT2c) receptor 87.16% 89.62%
CHEMBL3060 Q9Y345 Glycine transporter 2 83.81% 99.17%
CHEMBL4306 P22460 Voltage-gated potassium channel subunit Kv1.5 83.43% 94.03%
CHEMBL1293249 Q13887 Kruppel-like factor 5 82.62% 86.33%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 81.16% 95.56%
CHEMBL3401 O75469 Pregnane X receptor 80.07% 94.73%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
To see more specific details click the taxa you are interested in.
There are no matching plants.

Cross-Links

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PubChem 146683013
LOTUS LTS0184547
wikiData Q105162364