1-Methoxy-2,3,6,7-bismethylendioxyxanthon

Details

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Internal ID 3126d9db-2ed8-4f98-84ac-5d0bf886d3d5
Taxonomy Organoheterocyclic compounds > Benzopyrans > 1-benzopyrans > Xanthones
IUPAC Name 10-methoxy-2,6,8,16,18-pentaoxapentacyclo[11.7.0.03,11.05,9.015,19]icosa-1(20),3,5(9),10,13,15(19)-hexaen-12-one
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C16H10O7/c1-18-16-13-11(4-12-15(16)22-6-21-12)23-8-3-10-9(19-5-20-10)2-7(8)14(13)17/h2-4H,5-6H2,1H3
InChI Key HOZBZDJZIGVGHQ-UHFFFAOYSA-N
Popularity 3 references in papers

Physical and Chemical Properties

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Molecular Formula C16H10O7
Molecular Weight 314.25 g/mol
Exact Mass 314.04265265 g/mol
Topological Polar Surface Area (TPSA) 72.50 Ų
XlogP 2.60

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 1-Methoxy-2,3,6,7-bismethylendioxyxanthon

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
CHEMBL4303 P08238 Heat shock protein HSP 90-beta 98.89% 96.77%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 96.99% 91.11%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 95.19% 94.45%
CHEMBL4481 P35228 Nitric oxide synthase, inducible 93.11% 94.80%
CHEMBL4225 P49760 Dual specificity protein kinase CLK2 92.43% 80.96%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 92.39% 95.56%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 90.25% 94.00%
CHEMBL2373 P21730 C5a anaphylatoxin chemotactic receptor 90.19% 92.62%
CHEMBL3192 Q9BY41 Histone deacetylase 8 89.98% 93.99%
CHEMBL1806 P11388 DNA topoisomerase II alpha 88.80% 89.00%
CHEMBL2581 P07339 Cathepsin D 86.71% 98.95%
CHEMBL3401 O75469 Pregnane X receptor 84.12% 94.73%
CHEMBL230 P35354 Cyclooxygenase-2 83.90% 89.63%
CHEMBL5311 P37023 Serine/threonine-protein kinase receptor R3 82.51% 82.67%
CHEMBL1293249 Q13887 Kruppel-like factor 5 81.37% 86.33%
CHEMBL2717 Q9HCR9 Phosphodiesterase 11A 81.19% 85.00%
CHEMBL4224 P49759 Dual specificty protein kinase CLK1 81.00% 85.30%

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 101304458
LOTUS LTS0213448
wikiData Q105031593