Isopyridoxal
| Internal ID | 3010c0b8-c8b6-4cf5-a1fb-a524f04a87f0 |
| Taxonomy | Organoheterocyclic compounds > Pyridines and derivatives > Pyridine carboxaldehydes |
| IUPAC Name | 5-hydroxy-4-(hydroxymethyl)-6-methylpyridine-3-carbaldehyde |
| SMILES (Canonical) | CC1=NC=C(C(=C1O)CO)C=O |
| SMILES (Isomeric) | CC1=NC=C(C(=C1O)CO)C=O |
| InChI | InChI=1S/C8H9NO3/c1-5-8(12)7(4-11)6(3-10)2-9-5/h2-3,11-12H,4H2,1H3 |
| InChI Key | GNKXHPULSPWUAK-UHFFFAOYSA-N |
| Popularity | 8 references in papers |
| Molecular Formula | C8H9NO3 |
| Molecular Weight | 167.16 g/mol |
| Exact Mass | 167.058243149 g/mol |
| Topological Polar Surface Area (TPSA) | 70.40 Ų |
| XlogP | 0.00 |
| 5-hydroxy-4-(hydroxymethyl)-6-methylpyridine-3-carbaldehyde |
| 6560-46-9 |
| CHEBI:17889 |
| C06051 |
| Nicotinaldehyde, 5-hydroxy-4-(hydroxymethyl)-6-methyl- |
| 3-Pyridinecarboxaldehyde, 5-hydroxy-4-(hydroxymethyl)-6-methyl- |
| SCHEMBL10803937 |
| DTXSID90331537 |
| AKOS006310842 |
| FT-0705540 |
| There are more than 10 synonyms. If you wish to see them all click here. |
| 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 |
|---|---|---|---|---|
| CHEMBL1293267 | Q9HC97 | G-protein coupled receptor 35 | 96.10% | 89.34% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 93.04% | 95.56% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 91.33% | 94.73% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 84.60% | 99.17% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 83.60% | 90.00% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 82.56% | 96.09% |
| CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 81.91% | 96.00% |
| CHEMBL1163101 | O75460 | Serine/threonine-protein kinase/endoribonuclease IRE1 | 81.40% | 98.11% |
| CHEMBL5163 | Q9NY46 | Sodium channel protein type III alpha subunit | 81.38% | 96.90% |
| CHEMBL2107 | P61073 | C-X-C chemokine receptor type 4 | 80.70% | 93.10% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 80.45% | 91.11% |
| CHEMBL3492 | P49721 | Proteasome Macropain subunit | 80.12% | 90.24% |
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.
| There are no matching plants. |
| PubChem | 440899 |
| LOTUS | LTS0203463 |
| wikiData | Q27102705 |