2'-Hydroxydihydrodaidzein

Details

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Internal ID a501e44f-62b2-4508-85a9-8550f09e9d46
Taxonomy Phenylpropanoids and polyketides > Isoflavonoids > Isoflavans > Isoflavanones
IUPAC Name 3-(2,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydrochromen-4-one
SMILES (Canonical) C1C(C(=O)C2=C(O1)C=C(C=C2)O)C3=C(C=C(C=C3)O)O
SMILES (Isomeric) C1C(C(=O)C2=C(O1)C=C(C=C2)O)C3=C(C=C(C=C3)O)O
InChI InChI=1S/C15H12O5/c16-8-1-3-10(13(18)5-8)12-7-20-14-6-9(17)2-4-11(14)15(12)19/h1-6,12,16-18H,7H2
InChI Key WBOWBLGZAXVREM-UHFFFAOYSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C15H12O5
Molecular Weight 272.25 g/mol
Exact Mass 272.06847348 g/mol
Topological Polar Surface Area (TPSA) 87.00 Ų
XlogP 2.00

Synonyms

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2'-hydroxy-2,3-dihydrodaidzein
7,2',4'-Trihydroxyisoflavanone
2',4',7-trihydroxyisoflavanone
C03567
CHEBI:16035
(+/-)-2'-Hydroxydihydrodaidzein
3-(2,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydrochromen-4-one
LMPK12050463
Q27098345
3-(2,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydro-4H-chromen-4-one

2D Structure

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2D Structure of 2'-Hydroxydihydrodaidzein

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 97.33% 91.11%
CHEMBL2581 P07339 Cathepsin D 96.68% 98.95%
CHEMBL5697 Q9GZT9 Egl nine homolog 1 92.96% 93.40%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 92.79% 95.56%
CHEMBL1806 P11388 DNA topoisomerase II alpha 92.14% 89.00%
CHEMBL1994 P08235 Mineralocorticoid receptor 88.08% 100.00%
CHEMBL1860 P10827 Thyroid hormone receptor alpha 87.57% 99.15%
CHEMBL1293249 Q13887 Kruppel-like factor 5 85.64% 86.33%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 84.46% 99.23%
CHEMBL1929 P47989 Xanthine dehydrogenase 83.85% 96.12%
CHEMBL5845 P23415 Glycine receptor subunit alpha-1 83.76% 90.71%
CHEMBL3137262 O60341 LSD1/CoREST complex 83.63% 97.09%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 82.85% 96.09%
CHEMBL3194 P02766 Transthyretin 81.63% 90.71%
CHEMBL2535 P11166 Glucose transporter 81.55% 98.75%
CHEMBL5608 Q16288 NT-3 growth factor receptor 81.15% 95.89%
CHEMBL5966 P55899 IgG receptor FcRn large subunit p51 80.22% 90.93%

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.
Phaseolus coccineus
Phaseolus vulgaris

Cross-Links

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PubChem 440047
LOTUS LTS0230213
wikiData Q27098345