Spiciferone F

Details

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Internal ID 86b198b4-2cc5-49c8-8216-447264d755b5
Taxonomy Organoheterocyclic compounds > Benzopyrans > 1-benzopyrans > Chromones
IUPAC Name 7-ethyl-2,3,8-trimethylchromen-4-one
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C14H16O2/c1-5-11-6-7-12-13(15)8(2)10(4)16-14(12)9(11)3/h6-7H,5H2,1-4H3
InChI Key VSRNNNRDQPCMCV-UHFFFAOYSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C14H16O2
Molecular Weight 216.27 g/mol
Exact Mass 216.115029749 g/mol
Topological Polar Surface Area (TPSA) 26.30 Ų
XlogP 3.50

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of Spiciferone F

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
CHEMBL2581 P07339 Cathepsin D 94.01% 98.95%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 90.66% 95.56%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 89.96% 91.11%
CHEMBL3401 O75469 Pregnane X receptor 89.01% 94.73%
CHEMBL5409 Q8TDU6 G-protein coupled bile acid receptor 1 84.97% 93.65%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 83.62% 96.00%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 83.20% 94.00%
CHEMBL1293249 Q13887 Kruppel-like factor 5 82.81% 86.33%
CHEMBL2717 Q9HCR9 Phosphodiesterase 11A 82.32% 85.00%
CHEMBL3192 Q9BY41 Histone deacetylase 8 81.62% 93.99%
CHEMBL1806 P11388 DNA topoisomerase II alpha 81.46% 89.00%
CHEMBL4481 P35228 Nitric oxide synthase, inducible 81.00% 94.80%

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 139589528
LOTUS LTS0082115
wikiData Q104199758