2,4-Dihydroxy-3-methyl-6-[(2-methyl-2,3-dihydropyran-6-ylidene)methyl]benzaldehyde
| Internal ID | 971f6b3f-9097-4ec2-9554-d74c1b539024 |
| Taxonomy | Organic oxygen compounds > Organooxygen compounds > Carbonyl compounds > Benzaldehydes > Hydroxybenzaldehydes |
| IUPAC Name | 2,4-dihydroxy-3-methyl-6-[(2-methyl-2,3-dihydropyran-6-ylidene)methyl]benzaldehyde |
| SMILES (Canonical) | CC1CC=CC(=CC2=CC(=C(C(=C2C=O)O)C)O)O1 |
| SMILES (Isomeric) | CC1CC=CC(=CC2=CC(=C(C(=C2C=O)O)C)O)O1 |
| InChI | InChI=1S/C15H16O4/c1-9-4-3-5-12(19-9)6-11-7-14(17)10(2)15(18)13(11)8-16/h3,5-9,17-18H,4H2,1-2H3 |
| InChI Key | YUNYOSJRYNLHEN-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C15H16O4 |
| Molecular Weight | 260.28 g/mol |
| Exact Mass | 260.10485899 g/mol |
| Topological Polar Surface Area (TPSA) | 66.80 Ų |
| XlogP | 3.30 |
| There are no found synonyms. |
![2D Structure of 2,4-Dihydroxy-3-methyl-6-[(2-methyl-2,3-dihydropyran-6-ylidene)methyl]benzaldehyde](https://plantaedb.com/storage/docs/compounds/2023/11/24-dihydroxy-3-methyl-6-2-methyl-23-dihydropyran-6-ylidenemethylbenzaldehyde.jpg "2D Structure of 2,4-Dihydroxy-3-methyl-6-[(2-methyl-2,3-dihydropyran-6-ylidene)methyl]benzaldehyde")
| 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 |
|---|---|---|---|---|
| CHEMBL1163101 | O75460 | Serine/threonine-protein kinase/endoribonuclease IRE1 | 98.40% | 98.11% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 96.45% | 95.56% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 94.59% | 91.49% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 92.18% | 91.11% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 91.58% | 89.00% |
| CHEMBL1293255 | P15428 | 15-hydroxyprostaglandin dehydrogenase [NAD+] | 88.82% | 83.57% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 86.98% | 94.73% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 85.24% | 100.00% |
| CHEMBL2964 | P36507 | Dual specificity mitogen-activated protein kinase kinase 2 | 83.18% | 80.00% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 82.18% | 90.71% |
| CHEMBL4530 | P00488 | Coagulation factor XIII | 82.08% | 96.00% |
| CHEMBL3145 | P42338 | PI3-kinase p110-beta subunit | 82.08% | 98.75% |
| CHEMBL4803 | P29474 | Nitric-oxide synthase, endothelial | 81.99% | 86.00% |
| CHEMBL5697 | Q9GZT9 | Egl nine homolog 1 | 81.75% | 93.40% |
| CHEMBL2007 | P16234 | Platelet-derived growth factor receptor alpha | 81.21% | 91.07% |
| CHEMBL241 | Q14432 | Phosphodiesterase 3A | 80.58% | 92.94% |
| CHEMBL4481 | P35228 | Nitric oxide synthase, inducible | 80.41% | 94.80% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 80.10% | 99.23% |
Below are displayed all the plants proven (via scientific papers) to contain this
compound!
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| There are no matching plants. |
| PubChem | 163060375 |
| LOTUS | LTS0194620 |
| wikiData | Q104202106 |