(3R)-3,5-dihydroxy-7-(7-hydroxy-2,2-dimethylchromen-6-yl)-2,2-dimethyl-3,4-dihydropyrano[3,2-g]chromen-6-one
Internal ID | 02052263-1d58-43bf-9375-b7bb1c9a49f1 |
Taxonomy | Phenylpropanoids and polyketides > Isoflavonoids > Isoflavans > Isoflavanones > 6-prenylated isoflavanones |
IUPAC Name | (3R)-3,5-dihydroxy-7-(7-hydroxy-2,2-dimethylchromen-6-yl)-2,2-dimethyl-3,4-dihydropyrano[3,2-g]chromen-6-one |
SMILES (Canonical) | CC1(C=CC2=CC(=C(C=C2O1)O)C3=COC4=CC5=C(CC(C(O5)(C)C)O)C(=C4C3=O)O)C |
SMILES (Isomeric) | CC1(C=CC2=CC(=C(C=C2O1)O)C3=COC4=CC5=C(C[C@H](C(O5)(C)C)O)C(=C4C3=O)O)C |
InChI | InChI=1S/C25H24O7/c1-24(2)6-5-12-7-13(16(26)9-17(12)31-24)15-11-30-19-10-18-14(22(28)21(19)23(15)29)8-20(27)25(3,4)32-18/h5-7,9-11,20,26-28H,8H2,1-4H3/t20-/m1/s1 |
InChI Key | PMEVOTIFTLKYSQ-HXUWFJFHSA-N |
Popularity | 0 references in papers |
Molecular Formula | C25H24O7 |
Molecular Weight | 436.50 g/mol |
Exact Mass | 436.15220310 g/mol |
Topological Polar Surface Area (TPSA) | 105.00 Ų |
XlogP | 3.90 |
There are no found synonyms. |
![2D Structure of (3R)-3,5-dihydroxy-7-(7-hydroxy-2,2-dimethylchromen-6-yl)-2,2-dimethyl-3,4-dihydropyrano[3,2-g]chromen-6-one 2D Structure of (3R)-3,5-dihydroxy-7-(7-hydroxy-2,2-dimethylchromen-6-yl)-2,2-dimethyl-3,4-dihydropyrano[3,2-g]chromen-6-one](https://plantaedb.com/storage/docs/compounds/2023/11/75885300-846f-11ee-9fb6-6d8ba570a3f7.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 | 99.55% | 91.11% |
CHEMBL2581 | P07339 | Cathepsin D | 98.37% | 98.95% |
CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 96.81% | 89.00% |
CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 91.84% | 95.56% |
CHEMBL1951 | P21397 | Monoamine oxidase A | 90.06% | 91.49% |
CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 89.05% | 85.14% |
CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 88.59% | 86.33% |
CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 87.05% | 94.45% |
CHEMBL4303 | P08238 | Heat shock protein HSP 90-beta | 86.32% | 96.77% |
CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 86.29% | 99.23% |
CHEMBL2553 | Q15418 | Ribosomal protein S6 kinase alpha 1 | 85.89% | 85.11% |
CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 85.32% | 96.09% |
CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 85.03% | 90.71% |
CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 83.72% | 94.00% |
CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 83.63% | 95.89% |
CHEMBL4208 | P20618 | Proteasome component C5 | 81.40% | 90.00% |
CHEMBL1994 | P08235 | Mineralocorticoid receptor | 81.01% | 100.00% |
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.
Eriosema kraussianum |
PubChem | 162897018 |
LOTUS | LTS0114399 |
wikiData | Q105211426 |