Fortuneanoside E

Details

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Internal ID fd1acb9c-a264-4d9a-a7c9-5e52f4e9846f
Taxonomy Organic oxygen compounds > Organooxygen compounds > Carbohydrates and carbohydrate conjugates > Glycosyl compounds > Phenolic glycosides
IUPAC Name (2S,3R,4S,5S,6R)-2-[2-hydroxy-4-(4-hydroxy-3,5-dimethoxyphenyl)phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C20H24O10/c1-27-13-6-10(7-14(28-2)16(13)23)9-3-4-12(11(22)5-9)29-20-19(26)18(25)17(24)15(8-21)30-20/h3-7,15,17-26H,8H2,1-2H3/t15-,17-,18+,19-,20-/m1/s1
InChI Key LNEZLIPXCBMQAT-XIKSMUEASA-N
Popularity 4 references in papers

Physical and Chemical Properties

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Molecular Formula C20H24O10
Molecular Weight 424.40 g/mol
Exact Mass 424.13694696 g/mol
Topological Polar Surface Area (TPSA) 158.00 Ų
XlogP -0.20

Synonyms

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FORTUNEANOSIDE E
BDBM50269344
3,4''-dihydroxy-3'',5''-dimethoxy-(1,1''-biphenyl)-4-O-beta-d-glucoside

2D Structure

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2D Structure of Fortuneanoside E

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
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 97.94% 96.09%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 95.80% 91.11%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 93.81% 94.00%
CHEMBL2581 P07339 Cathepsin D 92.87% 98.95%
CHEMBL1293249 Q13887 Kruppel-like factor 5 91.38% 86.33%
CHEMBL4016 P42262 Glutamate receptor ionotropic, AMPA 2 89.71% 86.92%
CHEMBL3060 Q9Y345 Glycine transporter 2 89.22% 99.17%
CHEMBL241 Q14432 Phosphodiesterase 3A 88.93% 92.94%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 87.62% 96.00%
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 87.06% 85.14%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 86.94% 94.45%
CHEMBL5608 Q16288 NT-3 growth factor receptor 86.24% 95.89%
CHEMBL1806 P11388 DNA topoisomerase II alpha 85.56% 89.00%
CHEMBL1860 P10827 Thyroid hormone receptor alpha 84.29% 99.15%
CHEMBL3401 O75469 Pregnane X receptor 83.48% 94.73%
CHEMBL5339 Q5NUL3 G-protein coupled receptor 120 81.32% 95.78%
CHEMBL2373 P21730 C5a anaphylatoxin chemotactic receptor 80.95% 92.62%

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.
Pyracantha crenulata

Cross-Links

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PubChem 11844494
LOTUS LTS0084489
wikiData Q105154299