Pseudospumigin F
| Internal ID | b5fcd6eb-3231-4cd0-ad36-fe0f4dd0184b |
| Taxonomy | Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Peptides |
| IUPAC Name | (2S)-N-[5-(diaminomethylideneamino)-1-oxopentan-2-yl]-2-[[2-[[2-hydroxy-3-(4-hydroxyphenyl)propanoyl]amino]-4-phenylbutanoyl]amino]-3-methylbutanamide |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C30H42N6O6/c1-19(2)26(29(42)34-22(18-37)9-6-16-33-30(31)32)36-27(40)24(15-12-20-7-4-3-5-8-20)35-28(41)25(39)17-21-10-13-23(38)14-11-21/h3-5,7-8,10-11,13-14,18-19,22,24-26,38-39H,6,9,12,15-17H2,1-2H3,(H,34,42)(H,35,41)(H,36,40)(H4,31,32,33)/t22?,24?,25?,26-/m0/s1 |
| InChI Key | ZCYAPDWORPSULN-WSXXUSQGSA-N |
| Popularity | 4 references in papers |
| Molecular Formula | C30H42N6O6 |
| Molecular Weight | 582.70 g/mol |
| Exact Mass | 582.31658308 g/mol |
| Topological Polar Surface Area (TPSA) | 209.00 Ų |
| XlogP | 1.70 |
| DTXSID801334139 |
| 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 |
|---|---|---|---|---|
| CHEMBL2581 | P07339 | Cathepsin D | 99.69% | 98.95% |
| CHEMBL4072 | P07858 | Cathepsin B | 99.68% | 93.67% |
| CHEMBL3837 | P07711 | Cathepsin L | 98.87% | 96.61% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 96.82% | 96.09% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 96.40% | 91.11% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 96.39% | 99.17% |
| CHEMBL1907591 | P30926 | Neuronal acetylcholine receptor; alpha4/beta4 | 95.25% | 100.00% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 94.93% | 95.56% |
| CHEMBL3492 | P49721 | Proteasome Macropain subunit | 94.71% | 90.24% |
| CHEMBL5939 | Q9NZ08 | Endoplasmic reticulum aminopeptidase 1 | 94.25% | 100.00% |
| CHEMBL3891 | P07384 | Calpain 1 | 92.81% | 93.04% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 92.23% | 94.45% |
| CHEMBL3091268 | Q92753 | Nuclear receptor ROR-beta | 91.69% | 95.50% |
| CHEMBL3359 | P21462 | Formyl peptide receptor 1 | 91.26% | 93.56% |
| CHEMBL2514 | O95665 | Neurotensin receptor 2 | 91.03% | 100.00% |
| CHEMBL2535 | P11166 | Glucose transporter | 90.82% | 98.75% |
| CHEMBL1255126 | O15151 | Protein Mdm4 | 89.07% | 90.20% |
| CHEMBL1907603 | Q05586 | Glutamate NMDA receptor; GRIN1/GRIN2B | 88.15% | 95.89% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 87.01% | 90.71% |
| CHEMBL3286 | P00749 | Urokinase-type plasminogen activator | 86.72% | 97.88% |
| CHEMBL236 | P41143 | Delta opioid receptor | 85.75% | 99.35% |
| CHEMBL1907594 | P30926 | Neuronal acetylcholine receptor; alpha3/beta4 | 84.11% | 97.23% |
| CHEMBL3902 | P09211 | Glutathione S-transferase Pi | 84.05% | 93.81% |
| CHEMBL5261 | Q7L7X3 | Serine/threonine-protein kinase TAO1 | 83.68% | 89.33% |
| CHEMBL3004 | P33527 | Multidrug resistance-associated protein 1 | 83.45% | 96.37% |
| CHEMBL2288 | Q13526 | Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 | 82.48% | 91.71% |
| CHEMBL5701 | Q9H2K8 | Serine/threonine-protein kinase TAO3 | 82.46% | 96.67% |
| CHEMBL3807 | P17706 | T-cell protein-tyrosine phosphatase | 81.60% | 93.00% |
| CHEMBL5028 | O14672 | ADAM10 | 81.06% | 97.50% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 81.00% | 94.73% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 80.84% | 86.33% |
| CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 80.35% | 96.00% |
| CHEMBL4227 | P25090 | Lipoxin A4 receptor | 80.01% | 100.00% |
Below are displayed all the plants proven (via scientific papers) to contain this
compound!
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| There are no matching plants. |
| PubChem | 146683756 |
| LOTUS | LTS0121513 |
| wikiData | Q105371804 |