Thelephantin F

Details

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Internal ID a61ba4ff-ef34-4c82-a6b9-d49d035b6ed4
Taxonomy Benzenoids > Benzene and substituted derivatives > Terphenyls > P-terphenyls
IUPAC Name [2,5-dihydroxy-3,6-bis(4-hydroxyphenyl)-4-(2-phenylacetyl)oxyphenyl] 3,4-dimethylpentanoate
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C33H32O8/c1-19(2)20(3)17-26(36)40-32-28(22-9-13-24(34)14-10-22)31(39)33(41-27(37)18-21-7-5-4-6-8-21)29(30(32)38)23-11-15-25(35)16-12-23/h4-16,19-20,34-35,38-39H,17-18H2,1-3H3
InChI Key AHONBSJSZASARD-UHFFFAOYSA-N
Popularity 4 references in papers

Physical and Chemical Properties

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Molecular Formula C33H32O8
Molecular Weight 556.60 g/mol
Exact Mass 556.20971797 g/mol
Topological Polar Surface Area (TPSA) 134.00 Ų
XlogP 6.90

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of Thelephantin 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 99.17% 98.95%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 95.58% 96.09%
CHEMBL1860 P10827 Thyroid hormone receptor alpha 93.40% 99.15%
CHEMBL2288 Q13526 Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 92.78% 91.71%
CHEMBL3091268 Q92753 Nuclear receptor ROR-beta 92.03% 95.50%
CHEMBL3060 Q9Y345 Glycine transporter 2 90.55% 99.17%
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 88.41% 85.14%
CHEMBL2035 P08912 Muscarinic acetylcholine receptor M5 87.35% 94.62%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 86.54% 95.56%
CHEMBL1293249 Q13887 Kruppel-like factor 5 85.63% 86.33%
CHEMBL1907603 Q05586 Glutamate NMDA receptor; GRIN1/GRIN2B 85.51% 95.89%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 84.00% 91.11%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 83.46% 94.45%
CHEMBL3401 O75469 Pregnane X receptor 83.29% 94.73%
CHEMBL245 P20309 Muscarinic acetylcholine receptor M3 83.06% 97.53%
CHEMBL2345 P51812 Ribosomal protein S6 kinase alpha 3 82.77% 95.64%
CHEMBL1907591 P30926 Neuronal acetylcholine receptor; alpha4/beta4 80.84% 100.00%

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 101260623
LOTUS LTS0201477
wikiData Q77515467