6-Hydroxy-5-methoxy-7-phenyl-3h-benzo[de]isochromen-1-one
| Internal ID | 33f31df4-8e12-4195-8979-27d8c3806a41 |
| Taxonomy | Benzenoids > Naphthalenes > Naphthols and derivatives |
| IUPAC Name | 8-hydroxy-7-methoxy-10-phenyl-3-oxatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaen-2-one |
| SMILES (Canonical) | COC1=C(C2=C(C=CC3=C2C(=C1)COC3=O)C4=CC=CC=C4)O |
| SMILES (Isomeric) | COC1=C(C2=C(C=CC3=C2C(=C1)COC3=O)C4=CC=CC=C4)O |
| InChI | InChI=1S/C19H14O4/c1-22-15-9-12-10-23-19(21)14-8-7-13(11-5-3-2-4-6-11)17(16(12)14)18(15)20/h2-9,20H,10H2,1H3 |
| InChI Key | SXWREBCNSRFADJ-UHFFFAOYSA-N |
| Popularity | 1 reference in papers |
| Molecular Formula | C19H14O4 |
| Molecular Weight | 306.30 g/mol |
| Exact Mass | 306.08920892 g/mol |
| Topological Polar Surface Area (TPSA) | 55.80 Ų |
| XlogP | 3.80 |
| 8-Hydroxy-7-methoxy-10-phenyl-3-oxatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaen-2-one |
![2D Structure of 6-Hydroxy-5-methoxy-7-phenyl-3h-benzo[de]isochromen-1-one](https://plantaedb.com/storage/docs/compounds/2023/11/6-hydroxy-5-methoxy-7-phenyl-3h-benzodeisochromen-1-one.jpg "2D Structure of 6-Hydroxy-5-methoxy-7-phenyl-3h-benzo[de]isochromen-1-one")
| 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 | 98.13% | 91.11% |
| CHEMBL2581 | P07339 | Cathepsin D | 97.30% | 98.95% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 97.04% | 86.33% |
| CHEMBL2002 | P12268 | Inosine-5'-monophosphate dehydrogenase 2 | 96.82% | 98.21% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 96.45% | 95.56% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 95.61% | 91.49% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 90.16% | 96.09% |
| CHEMBL3192 | Q9BY41 | Histone deacetylase 8 | 88.25% | 93.99% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 87.97% | 94.00% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 86.16% | 89.00% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 85.83% | 99.17% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 83.74% | 85.14% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 81.29% | 99.23% |
| CHEMBL1907 | P15144 | Aminopeptidase N | 80.96% | 93.31% |
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.
| Xiphidium caeruleum |
| PubChem | 23244116 |
| LOTUS | LTS0231666 |
| wikiData | Q105263380 |