5,4',5'-Trihydroxy-3,6,7,8,2'-pentamethoxyflavone

Details

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Internal ID a5dd6e54-bc89-4d99-b2a8-0b208fc82301
Taxonomy Phenylpropanoids and polyketides > Flavonoids > O-methylated flavonoids > 8-O-methylated flavonoids
IUPAC Name 2-(4,5-dihydroxy-2-methoxyphenyl)-5-hydroxy-3,6,7,8-tetramethoxychromen-4-one
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C20H20O10/c1-25-11-7-10(22)9(21)6-8(11)15-17(26-2)13(23)12-14(24)18(27-3)20(29-5)19(28-4)16(12)30-15/h6-7,21-22,24H,1-5H3
InChI Key PQFNFPRJGFXWNM-UHFFFAOYSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C20H20O10
Molecular Weight 420.40 g/mol
Exact Mass 420.10564683 g/mol
Topological Polar Surface Area (TPSA) 133.00 Ų
XlogP 2.70

Synonyms

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LMPK12113381

2D Structure

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2D Structure of 5,4',5'-Trihydroxy-3,6,7,8,2'-pentamethoxyflavone

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 98.99% 91.11%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 93.99% 94.00%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 92.25% 95.56%
CHEMBL1293249 Q13887 Kruppel-like factor 5 90.70% 86.33%
CHEMBL1806 P11388 DNA topoisomerase II alpha 90.69% 89.00%
CHEMBL2581 P07339 Cathepsin D 87.43% 98.95%
CHEMBL3864 Q06124 Protein-tyrosine phosphatase 2C 87.01% 94.42%
CHEMBL3060 Q9Y345 Glycine transporter 2 85.85% 99.17%
CHEMBL2535 P11166 Glucose transporter 85.20% 98.75%
CHEMBL3194 P02766 Transthyretin 85.10% 90.71%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 85.09% 99.23%
CHEMBL2002 P12268 Inosine-5'-monophosphate dehydrogenase 2 83.96% 98.21%
CHEMBL1163101 O75460 Serine/threonine-protein kinase/endoribonuclease IRE1 83.61% 98.11%
CHEMBL1860 P10827 Thyroid hormone receptor alpha 82.03% 99.15%
CHEMBL3401 O75469 Pregnane X receptor 81.40% 94.73%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 80.91% 94.45%
CHEMBL4208 P20618 Proteasome component C5 80.16% 90.00%

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.
Gymnosperma glutinosum

Cross-Links

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PubChem 13942677
LOTUS LTS0080791
wikiData Q105213212