Fortuneanoside B

Details

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Internal ID 1814d47c-9964-42d2-89c3-ecba05436b0f
Taxonomy Organic oxygen compounds > Organooxygen compounds > Carbohydrates and carbohydrate conjugates > Glycosyl compounds > Phenolic glycosides
IUPAC Name (2S,3R,4S,5S,6R)-2-[3-hydroxy-2,4-dimethoxy-6-(2-methoxyphenyl)phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C21H26O10/c1-27-12-7-5-4-6-10(12)11-8-13(28-2)16(24)20(29-3)19(11)31-21-18(26)17(25)15(23)14(9-22)30-21/h4-8,14-15,17-18,21-26H,9H2,1-3H3/t14-,15-,17+,18-,21+/m1/s1
InChI Key YGNDHZPKLQTLBF-LOYVVIFBSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C21H26O10
Molecular Weight 438.40 g/mol
Exact Mass 438.15259702 g/mol
Topological Polar Surface Area (TPSA) 147.00 Ų
XlogP 0.90

Synonyms

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FORTUNEANOSIDE B
BDBM50269341
4''-hydroxy-2,3'',5''-trimethoxy-(1,1''-biphenyl)-2''-O-beta-d-glucoside

2D Structure

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2D Structure of Fortuneanoside B

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 99.18% 91.11%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 97.42% 96.09%
CHEMBL2581 P07339 Cathepsin D 93.46% 98.95%
CHEMBL1293249 Q13887 Kruppel-like factor 5 92.89% 86.33%
CHEMBL225 P28335 Serotonin 2c (5-HT2c) receptor 90.56% 89.62%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 90.14% 96.00%
CHEMBL3060 Q9Y345 Glycine transporter 2 89.94% 99.17%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 88.02% 95.56%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 87.45% 94.00%
CHEMBL1806 P11388 DNA topoisomerase II alpha 85.40% 89.00%
CHEMBL2535 P11166 Glucose transporter 84.06% 98.75%
CHEMBL3401 O75469 Pregnane X receptor 80.59% 94.73%

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 11844492
LOTUS LTS0081941
wikiData Q105348170