Furodysinin lactone

Details

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Internal ID 74d6597a-1cc4-41b2-8efa-a0da998b0ee8
Taxonomy Organoheterocyclic compounds > Naphthofurans
IUPAC Name (4aS,8aR,9aR)-9a-hydroxy-4,4,7-trimethyl-5,6,8a,9-tetrahydro-4aH-benzo[f][1]benzofuran-2-one
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C15H20O3/c1-9-4-5-11-10(6-9)8-15(17)12(14(11,2)3)7-13(16)18-15/h6-7,10-11,17H,4-5,8H2,1-3H3/t10-,11-,15+/m0/s1
InChI Key FGUPQPDMAULLNU-ZIBATOQPSA-N
Popularity 7 references in papers

Physical and Chemical Properties

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Molecular Formula C15H20O3
Molecular Weight 248.32 g/mol
Exact Mass 248.14124450 g/mol
Topological Polar Surface Area (TPSA) 46.50 Ų
XlogP 2.00

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of Furodysinin lactone

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 96.21% 91.11%
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 91.92% 85.14%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 91.36% 95.56%
CHEMBL1871 P10275 Androgen Receptor 90.23% 96.43%
CHEMBL1994 P08235 Mineralocorticoid receptor 89.52% 100.00%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 89.44% 96.09%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 87.99% 99.23%
CHEMBL3137262 O60341 LSD1/CoREST complex 86.42% 97.09%
CHEMBL253 P34972 Cannabinoid CB2 receptor 86.17% 97.25%
CHEMBL2581 P07339 Cathepsin D 85.03% 98.95%
CHEMBL1806 P11388 DNA topoisomerase II alpha 84.23% 89.00%

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.
There are no matching plants.

Cross-Links

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PubChem 139066358
LOTUS LTS0200173
wikiData Q104401492