2-[2,4-Dihydroxy-5-(2-methylbut-3-en-2-yl)phenyl]-5,7-dihydroxy-8-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one
Internal ID | acb8264f-0162-4655-b8a7-af3c135b68c4 |
Taxonomy | Phenylpropanoids and polyketides > Flavonoids > Flavans > 8-prenylated flavans > 8-prenylated flavanones |
IUPAC Name | 2-[2,4-dihydroxy-5-(2-methylbut-3-en-2-yl)phenyl]-5,7-dihydroxy-8-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one |
SMILES (Canonical) | CC(=CCC1=C2C(=C(C=C1O)O)C(=O)CC(O2)C3=CC(=C(C=C3O)O)C(C)(C)C=C)C |
SMILES (Isomeric) | CC(=CCC1=C2C(=C(C=C1O)O)C(=O)CC(O2)C3=CC(=C(C=C3O)O)C(C)(C)C=C)C |
InChI | InChI=1S/C25H28O6/c1-6-25(4,5)16-9-15(18(27)10-19(16)28)22-12-21(30)23-20(29)11-17(26)14(24(23)31-22)8-7-13(2)3/h6-7,9-11,22,26-29H,1,8,12H2,2-5H3 |
InChI Key | PCNCQAWYRGWMFH-UHFFFAOYSA-N |
Popularity | 1 reference in papers |
Molecular Formula | C25H28O6 |
Molecular Weight | 424.50 g/mol |
Exact Mass | 424.18858861 g/mol |
Topological Polar Surface Area (TPSA) | 107.00 Ų |
XlogP | 5.90 |
There are no found synonyms. |
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 | 98.59% | 91.11% |
CHEMBL2581 | P07339 | Cathepsin D | 96.90% | 98.95% |
CHEMBL3401 | O75469 | Pregnane X receptor | 94.13% | 94.73% |
CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 93.43% | 85.14% |
CHEMBL1293267 | Q9HC97 | G-protein coupled receptor 35 | 92.84% | 89.34% |
CHEMBL5697 | Q9GZT9 | Egl nine homolog 1 | 90.46% | 93.40% |
CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 89.83% | 95.56% |
CHEMBL1902 | P62942 | FK506-binding protein 1A | 88.83% | 97.05% |
CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 86.57% | 86.33% |
CHEMBL2007 | P16234 | Platelet-derived growth factor receptor alpha | 85.91% | 91.07% |
CHEMBL1951 | P21397 | Monoamine oxidase A | 85.35% | 91.49% |
CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 85.19% | 89.00% |
CHEMBL2964 | P36507 | Dual specificity mitogen-activated protein kinase kinase 2 | 85.04% | 80.00% |
CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 83.80% | 96.09% |
CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 83.71% | 95.89% |
CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 83.27% | 94.45% |
CHEMBL1994 | P08235 | Mineralocorticoid receptor | 81.12% | 100.00% |
CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 81.08% | 99.23% |
CHEMBL226 | P30542 | Adenosine A1 receptor | 80.16% | 95.93% |
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.
Dalea scandens |
Dalea versicolor |
PubChem | 44566722 |
LOTUS | LTS0270519 |
wikiData | Q105205886 |