8-Methoxy-3,4,5-trimethyl-5,6,7,8-tetrahydrobenzo[f][1]benzofuran

Details

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Internal ID e428808b-c5ed-4b22-b976-3bfdcb0952ac
Taxonomy Lipids and lipid-like molecules > Prenol lipids > Sesquiterpenoids > Eremophilane, 8,9-secoeremophilane and furoeremophilane sesquiterpenoids
IUPAC Name 8-methoxy-3,4,5-trimethyl-5,6,7,8-tetrahydrobenzo[f][1]benzofuran
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C16H20O2/c1-9-5-6-13(17-4)12-7-14-16(10(2)8-18-14)11(3)15(9)12/h7-9,13H,5-6H2,1-4H3
InChI Key JEUYDTPWGDAPMX-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C16H20O2
Molecular Weight 244.33 g/mol
Exact Mass 244.146329876 g/mol
Topological Polar Surface Area (TPSA) 22.40 Ų
XlogP 3.80

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 8-Methoxy-3,4,5-trimethyl-5,6,7,8-tetrahydrobenzo[f][1]benzofuran

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 94.94% 91.11%
CHEMBL241 Q14432 Phosphodiesterase 3A 90.95% 92.94%
CHEMBL3137262 O60341 LSD1/CoREST complex 87.37% 97.09%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 83.15% 95.56%
CHEMBL5608 Q16288 NT-3 growth factor receptor 82.86% 95.89%
CHEMBL2781 P19634 Sodium/hydrogen exchanger 1 82.69% 90.24%
CHEMBL225 P28335 Serotonin 2c (5-HT2c) receptor 82.12% 89.62%
CHEMBL1913 P09619 Platelet-derived growth factor receptor beta 81.18% 95.70%
CHEMBL1806 P11388 DNA topoisomerase II alpha 80.62% 89.00%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 80.50% 94.00%
CHEMBL2581 P07339 Cathepsin D 80.23% 98.95%

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.
Euryops arabicus

Cross-Links

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PubChem 14237584
LOTUS LTS0078049
wikiData Q105126428