Lecanorin E

Details

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Internal ID d0f11d29-ae6f-45ed-990b-e12b0137aebc
Taxonomy Phenylpropanoids and polyketides > Depsides and depsidones
IUPAC Name (3-hydroxy-5-methylphenyl) 2,4-dihydroxy-3,6-dimethylbenzoate
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C16H16O5/c1-8-4-11(17)7-12(5-8)21-16(20)14-9(2)6-13(18)10(3)15(14)19/h4-7,17-19H,1-3H3
InChI Key BCUKIUGDTDBGBP-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) 87.00 Ų
XlogP 3.90

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of Lecanorin E

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 94.36% 91.11%
CHEMBL5409 Q8TDU6 G-protein coupled bile acid receptor 1 90.87% 93.65%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 90.54% 94.00%
CHEMBL2581 P07339 Cathepsin D 89.55% 98.95%
CHEMBL3401 O75469 Pregnane X receptor 87.53% 94.73%
CHEMBL1860 P10827 Thyroid hormone receptor alpha 87.06% 99.15%
CHEMBL215 P09917 Arachidonate 5-lipoxygenase 85.66% 92.68%
CHEMBL3194 P02766 Transthyretin 85.62% 90.71%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 85.04% 95.56%
CHEMBL4208 P20618 Proteasome component C5 84.78% 90.00%
CHEMBL1951 P21397 Monoamine oxidase A 83.69% 91.49%
CHEMBL1806 P11388 DNA topoisomerase II alpha 83.08% 89.00%
CHEMBL3864 Q06124 Protein-tyrosine phosphatase 2C 82.51% 94.42%
CHEMBL5966 P55899 IgG receptor FcRn large subunit p51 81.86% 90.93%
CHEMBL3060 Q9Y345 Glycine transporter 2 81.05% 99.17%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
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There are no matching plants.

Cross-Links

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PubChem 139587071
LOTUS LTS0082116
wikiData Q77520811