2-(4-hydroxyphenyl)-8-methoxy-3,4-dihydro-2H-chromen-7-ol

Details

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Internal ID 8c6801ec-26ea-4a9b-a630-2c73e54e4d73
Taxonomy Phenylpropanoids and polyketides > Flavonoids > O-methylated flavonoids > 8-O-methylated flavonoids
IUPAC Name 2-(4-hydroxyphenyl)-8-methoxy-3,4-dihydro-2H-chromen-7-ol
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C16H16O4/c1-19-16-13(18)8-4-11-5-9-14(20-15(11)16)10-2-6-12(17)7-3-10/h2-4,6-8,14,17-18H,5,9H2,1H3
InChI Key OVJRDXJZMGYZOM-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C16H16O4
Molecular Weight 272.29 g/mol
Exact Mass 272.10485899 g/mol
Topological Polar Surface Area (TPSA) 58.90 Ų
XlogP 3.10

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 2-(4-hydroxyphenyl)-8-methoxy-3,4-dihydro-2H-chromen-7-ol

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 98.08% 91.11%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 94.47% 96.09%
CHEMBL3137262 O60341 LSD1/CoREST complex 93.95% 97.09%
CHEMBL2041 P07949 Tyrosine-protein kinase receptor RET 90.00% 91.79%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 87.86% 95.56%
CHEMBL3438 Q05513 Protein kinase C zeta 86.85% 88.48%
CHEMBL5608 Q16288 NT-3 growth factor receptor 84.32% 95.89%
CHEMBL242 Q92731 Estrogen receptor beta 83.09% 98.35%
CHEMBL3060 Q9Y345 Glycine transporter 2 82.83% 99.17%
CHEMBL5311 P37023 Serine/threonine-protein kinase receptor R3 82.48% 82.67%
CHEMBL1907603 Q05586 Glutamate NMDA receptor; GRIN1/GRIN2B 82.08% 95.89%
CHEMBL5339 Q5NUL3 G-protein coupled receptor 120 81.97% 95.78%
CHEMBL4208 P20618 Proteasome component C5 81.93% 90.00%
CHEMBL3192 Q9BY41 Histone deacetylase 8 81.81% 93.99%
CHEMBL241 Q14432 Phosphodiesterase 3A 81.75% 92.94%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 81.73% 94.45%

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.
Dracaena draco

Cross-Links

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PubChem 163006620
LOTUS LTS0095782
wikiData Q105200766