Lactarotropone

Details

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Internal ID 220a490c-8000-4aa7-b5b9-93c0b616052f
Taxonomy Hydrocarbon derivatives > Tropones
IUPAC Name 5,7,7-trimethyl-6,8-dihydro-1H-azuleno[5,6-c]furan-3,9-dione
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C15H16O3/c1-8-4-9-12(7-18-14(9)17)13(16)11-6-15(2,3)5-10(8)11/h4H,5-7H2,1-3H3
InChI Key LRDFOPNJXHWGGG-UHFFFAOYSA-N
Popularity 3 references in papers

Physical and Chemical Properties

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Molecular Formula C15H16O3
Molecular Weight 244.28 g/mol
Exact Mass 244.109944368 g/mol
Topological Polar Surface Area (TPSA) 43.40 Ų
XlogP 1.70

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of Lactarotropone

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 94.38% 96.77%
CHEMBL5697 Q9GZT9 Egl nine homolog 1 94.28% 93.40%
CHEMBL1951 P21397 Monoamine oxidase A 94.12% 91.49%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 93.92% 95.56%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 93.81% 91.11%
CHEMBL2581 P07339 Cathepsin D 93.53% 98.95%
CHEMBL3880 P07900 Heat shock protein HSP 90-alpha 90.93% 96.21%
CHEMBL1293249 Q13887 Kruppel-like factor 5 87.12% 86.33%
CHEMBL4208 P20618 Proteasome component C5 84.84% 90.00%
CHEMBL2535 P11166 Glucose transporter 84.66% 98.75%
CHEMBL1806 P11388 DNA topoisomerase II alpha 84.47% 89.00%
CHEMBL4302 P08183 P-glycoprotein 1 81.72% 92.98%
CHEMBL1994 P08235 Mineralocorticoid receptor 80.20% 100.00%
CHEMBL5805 Q9NR97 Toll-like receptor 8 80.19% 96.25%

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 14314436
LOTUS LTS0073157
wikiData Q77568345