7-Methoxy-2,2-dimethyl-pyrano[3,2-g]chromen-8-one

Details

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Internal ID 733c26bd-be28-4a39-bd45-7732691e3401
Taxonomy Phenylpropanoids and polyketides > Coumarins and derivatives > Pyranocoumarins > Linear pyranocoumarins
IUPAC Name 7-methoxy-2,2-dimethylpyrano[3,2-g]chromen-8-one
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C15H14O4/c1-15(2)5-4-9-6-10-7-13(17-3)14(16)18-11(10)8-12(9)19-15/h4-8H,1-3H3
InChI Key JVLPIRMUUSKKDG-UHFFFAOYSA-N
Popularity 3 references in papers

Physical and Chemical Properties

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Molecular Formula C15H14O4
Molecular Weight 258.27 g/mol
Exact Mass 258.08920892 g/mol
Topological Polar Surface Area (TPSA) 44.80 Ų
XlogP 3.00

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 7-Methoxy-2,2-dimethyl-pyrano[3,2-g]chromen-8-one

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
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 96.24% 85.14%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 94.92% 91.11%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 92.11% 94.00%
CHEMBL1293249 Q13887 Kruppel-like factor 5 91.05% 86.33%
CHEMBL2581 P07339 Cathepsin D 89.30% 98.95%
CHEMBL4303 P08238 Heat shock protein HSP 90-beta 87.94% 96.77%
CHEMBL4224 P49759 Dual specificty protein kinase CLK1 86.87% 85.30%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 84.86% 99.23%
CHEMBL4208 P20618 Proteasome component C5 84.48% 90.00%
CHEMBL4478 Q00975 Voltage-gated N-type calcium channel alpha-1B subunit 81.41% 97.14%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 81.31% 95.56%

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.
Ficus nervosa

Cross-Links

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PubChem 155925067
LOTUS LTS0069902
wikiData Q105135830