(2R)-5-hydroxy-2-(4-hydroxyphenyl)-8,8-dimethyl-2,3-dihydropyrano[2,3-h]chromen-4-one
Internal ID | eaf9a4b0-7ea0-4263-b690-0c99c83e4b5d |
Taxonomy | Phenylpropanoids and polyketides > Flavonoids > Pyranoflavonoids |
IUPAC Name | (2R)-5-hydroxy-2-(4-hydroxyphenyl)-8,8-dimethyl-2,3-dihydropyrano[2,3-h]chromen-4-one |
SMILES (Canonical) | CC1(C=CC2=C(O1)C=C(C3=C2OC(CC3=O)C4=CC=C(C=C4)O)O)C |
SMILES (Isomeric) | CC1(C=CC2=C(O1)C=C(C3=C2O[C@H](CC3=O)C4=CC=C(C=C4)O)O)C |
InChI | InChI=1S/C20H18O5/c1-20(2)8-7-13-17(25-20)10-15(23)18-14(22)9-16(24-19(13)18)11-3-5-12(21)6-4-11/h3-8,10,16,21,23H,9H2,1-2H3/t16-/m1/s1 |
InChI Key | JTJIFFUHXHGAOQ-MRXNPFEDSA-N |
Popularity | 0 references in papers |
Molecular Formula | C20H18O5 |
Molecular Weight | 338.40 g/mol |
Exact Mass | 338.11542367 g/mol |
Topological Polar Surface Area (TPSA) | 76.00 Ų |
XlogP | 3.70 |
There are no found synonyms. |
![2D Structure of (2R)-5-hydroxy-2-(4-hydroxyphenyl)-8,8-dimethyl-2,3-dihydropyrano[2,3-h]chromen-4-one 2D Structure of (2R)-5-hydroxy-2-(4-hydroxyphenyl)-8,8-dimethyl-2,3-dihydropyrano[2,3-h]chromen-4-one](https://plantaedb.com/storage/docs/compounds/2023/11/2r-5-hydroxy-2-4-hydroxyphenyl-88-dimethyl-23-dihydropyrano23-hchromen-4-one.jpg)
Target | Value | Probability (raw) | Probability (%) |
---|---|---|---|
No predicted properties yet! |
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 | 99.19% | 91.11% |
CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 96.41% | 94.45% |
CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 94.76% | 85.14% |
CHEMBL2581 | P07339 | Cathepsin D | 94.32% | 98.95% |
CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 92.33% | 89.00% |
CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 92.16% | 96.09% |
CHEMBL3137262 | O60341 | LSD1/CoREST complex | 91.95% | 97.09% |
CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 90.42% | 95.56% |
CHEMBL4208 | P20618 | Proteasome component C5 | 89.33% | 90.00% |
CHEMBL2553 | Q15418 | Ribosomal protein S6 kinase alpha 1 | 89.06% | 85.11% |
CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 87.05% | 99.23% |
CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 83.38% | 99.15% |
CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 83.33% | 90.71% |
CHEMBL4051 | P13569 | Cystic fibrosis transmembrane conductance regulator | 82.99% | 95.71% |
CHEMBL2964 | P36507 | Dual specificity mitogen-activated protein kinase kinase 2 | 82.25% | 80.00% |
CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 81.86% | 95.89% |
CHEMBL5697 | Q9GZT9 | Egl nine homolog 1 | 81.44% | 93.40% |
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.
To see more specific details click the taxa you are interested in.
Erythrina fusca |
PubChem | 159018346 |
LOTUS | LTS0158560 |
wikiData | Q105134798 |