2,6,10,10-Tetramethyl-11-oxatricyclo[7.2.1.01,5]dodeca-2,6-diene

Details

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Internal ID c40d56ca-f839-4019-bc6b-f3220253bd1c
Taxonomy Organoheterocyclic compounds > Tetrahydrofurans
IUPAC Name 2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.01,5]dodeca-2,6-diene
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C15H22O/c1-10-5-7-12-9-15(16-14(12,3)4)11(2)6-8-13(10)15/h5-6,12-13H,7-9H2,1-4H3
InChI Key KVJMJCYPKZHEPD-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C15H22O
Molecular Weight 218.33 g/mol
Exact Mass 218.167065321 g/mol
Topological Polar Surface Area (TPSA) 9.20 Ų
XlogP 2.40

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 2,6,10,10-Tetramethyl-11-oxatricyclo[7.2.1.01,5]dodeca-2,6-diene

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 89.91% 91.11%
CHEMBL3137262 O60341 LSD1/CoREST complex 85.47% 97.09%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 84.07% 95.56%
CHEMBL4803 P29474 Nitric-oxide synthase, endothelial 83.03% 86.00%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 82.97% 96.09%
CHEMBL1994 P08235 Mineralocorticoid receptor 80.44% 100.00%

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 73803996
LOTUS LTS0211404
wikiData Q105146555