1-(5,8-Dimethoxy-2,2-dimethylchromen-6-yl)-3-hydroxy-3-phenylprop-2-en-1-one
| Internal ID | 36232381-8346-4a0e-a48f-f01f5ab51fba |
| Taxonomy | Organoheterocyclic compounds > Benzopyrans > 1-benzopyrans > 2,2-dimethyl-1-benzopyrans |
| IUPAC Name | 1-(5,8-dimethoxy-2,2-dimethylchromen-6-yl)-3-hydroxy-3-phenylprop-2-en-1-one |
| SMILES (Canonical) | CC1(C=CC2=C(C(=CC(=C2O1)OC)C(=O)C=C(C3=CC=CC=C3)O)OC)C |
| SMILES (Isomeric) | CC1(C=CC2=C(C(=CC(=C2O1)OC)C(=O)C=C(C3=CC=CC=C3)O)OC)C |
| InChI | InChI=1S/C22H22O5/c1-22(2)11-10-15-20(26-4)16(12-19(25-3)21(15)27-22)18(24)13-17(23)14-8-6-5-7-9-14/h5-13,23H,1-4H3 |
| InChI Key | FNPPAJNWJIODGD-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C22H22O5 |
| Molecular Weight | 366.40 g/mol |
| Exact Mass | 366.14672380 g/mol |
| Topological Polar Surface Area (TPSA) | 65.00 Ų |
| XlogP | 4.50 |
| 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 | 96.28% | 91.11% |
| CHEMBL1255126 | O15151 | Protein Mdm4 | 94.86% | 90.20% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 93.62% | 86.33% |
| CHEMBL2535 | P11166 | Glucose transporter | 93.39% | 98.75% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 93.00% | 95.56% |
| CHEMBL3091268 | Q92753 | Nuclear receptor ROR-beta | 91.24% | 95.50% |
| CHEMBL1293294 | P51151 | Ras-related protein Rab-9A | 90.46% | 87.67% |
| CHEMBL2007 | P16234 | Platelet-derived growth factor receptor alpha | 89.64% | 91.07% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 89.61% | 90.00% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 89.25% | 96.09% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 88.22% | 99.17% |
| CHEMBL4478 | Q00975 | Voltage-gated N-type calcium channel alpha-1B subunit | 87.00% | 97.14% |
| CHEMBL340 | P08684 | Cytochrome P450 3A4 | 81.27% | 91.19% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 81.18% | 99.23% |
| CHEMBL2035 | P08912 | Muscarinic acetylcholine receptor M5 | 80.12% | 94.62% |
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.
| Millettia erythrocalyx |
| Pongamia pinnata |
| PubChem | 129681911 |
| LOTUS | LTS0273891 |
| wikiData | Q104998435 |