[2-methoxy-5-[4-oxo-5-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-2-yl]phenyl] acetate
| Internal ID | 7bf4437b-0c91-4a18-bf2b-cf6f5269ca4e |
| Taxonomy | Phenylpropanoids and polyketides > Flavonoids > Flavonoid glycosides > Flavonoid O-glycosides |
| IUPAC Name | [2-methoxy-5-[4-oxo-5-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-2-yl]phenyl] acetate |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C24H24O10/c1-11-21(27)22(28)23(29)24(31-11)34-17-6-4-5-16-20(17)14(26)10-18(33-16)13-7-8-15(30-3)19(9-13)32-12(2)25/h4-11,21-24,27-29H,1-3H3/t11-,21-,22+,23+,24+/m0/s1 |
| InChI Key | URVIWHAOEMBTPJ-LVPOYPBKSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C24H24O10 |
| Molecular Weight | 472.40 g/mol |
| Exact Mass | 472.13694696 g/mol |
| Topological Polar Surface Area (TPSA) | 141.00 Ų |
| XlogP | 1.20 |
| There are no found synonyms. |
![2D Structure of [2-methoxy-5-[4-oxo-5-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-2-yl]phenyl] acetate](https://plantaedb.com/storage/docs/compounds/2023/11/90c6ce80-8562-11ee-9584-9fbd25fbb4ad.jpg "2D Structure of [2-methoxy-5-[4-oxo-5-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-2-yl]phenyl] acetate")
| 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 |
|---|---|---|---|---|
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 97.57% | 89.00% |
| CHEMBL2581 | P07339 | Cathepsin D | 97.48% | 98.95% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 97.34% | 86.33% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 96.67% | 85.14% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 96.59% | 91.11% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 95.95% | 94.00% |
| CHEMBL1293277 | O15118 | Niemann-Pick C1 protein | 95.05% | 81.11% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 90.88% | 96.09% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 89.55% | 95.56% |
| CHEMBL1293294 | P51151 | Ras-related protein Rab-9A | 89.16% | 87.67% |
| CHEMBL4306 | P22460 | Voltage-gated potassium channel subunit Kv1.5 | 85.84% | 94.03% |
| CHEMBL3714130 | P46095 | G-protein coupled receptor 6 | 85.00% | 97.36% |
| CHEMBL4478 | Q00975 | Voltage-gated N-type calcium channel alpha-1B subunit | 84.67% | 97.14% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 84.14% | 99.23% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 83.08% | 99.17% |
| CHEMBL5339 | Q5NUL3 | G-protein coupled receptor 120 | 82.48% | 95.78% |
| CHEMBL3091268 | Q92753 | Nuclear receptor ROR-beta | 82.44% | 95.50% |
| CHEMBL1907603 | Q05586 | Glutamate NMDA receptor; GRIN1/GRIN2B | 82.04% | 95.89% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 81.79% | 95.89% |
| CHEMBL2535 | P11166 | Glucose transporter | 80.95% | 98.75% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 80.69% | 90.71% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 80.07% | 94.73% |
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.
| Rhododendron lepidotum |
| PubChem | 162908842 |
| LOTUS | LTS0173239 |
| wikiData | Q105278059 |