(2R)-8,10-dihydroxy-2,5-dimethyl-2,3-dihydrobenzo[h]chromen-4-one

Details

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Internal ID 758c5158-c7ce-4cbf-8706-a1e0c5cdac6d
Taxonomy Organoheterocyclic compounds > Naphthopyrans > Naphthopyranones
IUPAC Name (2R)-8,10-dihydroxy-2,5-dimethyl-2,3-dihydrobenzo[h]chromen-4-one
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C15H14O4/c1-7-3-9-5-10(16)6-12(18)14(9)15-13(7)11(17)4-8(2)19-15/h3,5-6,8,16,18H,4H2,1-2H3/t8-/m1/s1
InChI Key LFEVSCCUJFVIFA-MRVPVSSYSA-N
Popularity 3 references in papers

Physical and Chemical Properties

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Molecular Formula C15H14O4
Molecular Weight 258.27 g/mol
Exact Mass 258.08920892 g/mol
Topological Polar Surface Area (TPSA) 66.80 Ų
XlogP 2.70

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of (2R)-8,10-dihydroxy-2,5-dimethyl-2,3-dihydrobenzo[h]chromen-4-one

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 97.12% 91.11%
CHEMBL2581 P07339 Cathepsin D 92.43% 98.95%
CHEMBL1929 P47989 Xanthine dehydrogenase 92.00% 96.12%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 91.65% 99.23%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 91.48% 95.56%
CHEMBL1951 P21397 Monoamine oxidase A 91.26% 91.49%
CHEMBL1806 P11388 DNA topoisomerase II alpha 89.36% 89.00%
CHEMBL1860 P10827 Thyroid hormone receptor alpha 89.28% 99.15%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 86.98% 94.00%
CHEMBL3401 O75469 Pregnane X receptor 86.76% 94.73%
CHEMBL4208 P20618 Proteasome component C5 83.64% 90.00%
CHEMBL2553 Q15418 Ribosomal protein S6 kinase alpha 1 82.94% 85.11%
CHEMBL5845 P23415 Glycine receptor subunit alpha-1 82.82% 90.71%
CHEMBL4803 P29474 Nitric-oxide synthase, endothelial 82.41% 86.00%
CHEMBL5409 Q8TDU6 G-protein coupled bile acid receptor 1 82.29% 93.65%
CHEMBL1293249 Q13887 Kruppel-like factor 5 81.92% 86.33%
CHEMBL4481 P35228 Nitric oxide synthase, inducible 80.95% 94.80%
CHEMBL3137262 O60341 LSD1/CoREST complex 80.53% 97.09%
CHEMBL241 Q14432 Phosphodiesterase 3A 80.38% 92.94%

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.
Eleutherine bulbosa

Cross-Links

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PubChem 102473740
LOTUS LTS0072223
wikiData Q105150986