Apigenin 7-lactate

Details

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Internal ID ed6aed5e-a5c0-41ad-9226-dc9e74a223fa
Taxonomy Phenylpropanoids and polyketides > Flavonoids > Flavones
IUPAC Name [5-hydroxy-2-(4-hydroxyphenyl)-4-oxochromen-7-yl] 2-hydroxypropanoate
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C18H14O7/c1-9(19)18(23)24-12-6-13(21)17-14(22)8-15(25-16(17)7-12)10-2-4-11(20)5-3-10/h2-9,19-21H,1H3
InChI Key HATNSSGJRODWED-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C18H14O7
Molecular Weight 342.30 g/mol
Exact Mass 342.07395278 g/mol
Topological Polar Surface Area (TPSA) 113.00 Ų
XlogP 1.60

Synonyms

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LMPK12110429

2D Structure

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2D Structure of Apigenin 7-lactate

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 97.93% 98.95%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 97.20% 91.11%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 96.90% 94.45%
CHEMBL1860 P10827 Thyroid hormone receptor alpha 96.12% 99.15%
CHEMBL1806 P11388 DNA topoisomerase II alpha 93.96% 89.00%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 92.29% 94.00%
CHEMBL5845 P23415 Glycine receptor subunit alpha-1 91.40% 90.71%
CHEMBL3194 P02766 Transthyretin 91.32% 90.71%
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 90.43% 85.14%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 90.28% 95.56%
CHEMBL3401 O75469 Pregnane X receptor 88.13% 94.73%
CHEMBL242 Q92731 Estrogen receptor beta 86.55% 98.35%
CHEMBL1293249 Q13887 Kruppel-like factor 5 85.29% 86.33%
CHEMBL5409 Q8TDU6 G-protein coupled bile acid receptor 1 83.42% 93.65%
CHEMBL3060 Q9Y345 Glycine transporter 2 82.60% 99.17%
CHEMBL4016 P42262 Glutamate receptor ionotropic, AMPA 2 82.39% 86.92%
CHEMBL5284 Q96RR4 CaM-kinase kinase beta 82.30% 89.23%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 81.38% 99.23%
CHEMBL2179 P04062 Beta-glucocerebrosidase 80.02% 85.31%

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.
Marrubium vulgare

Cross-Links

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PubChem 44257870
LOTUS LTS0217380
wikiData Q105025059