Macrotermycin B
| Internal ID | 75e35ec4-c068-4ca0-a34e-ee92167fdd10 |
| Taxonomy | Organic oxygen compounds > Organooxygen compounds > Carbohydrates and carbohydrate conjugates > Glycosyl compounds > O-glycosyl compounds |
| IUPAC Name | (1S,2R,5S,8S,9E,11Z,13S,18S,19R,20R)-2-[(2R,3S,4S,5S)-3-amino-4,5-dihydroxyoxan-2-yl]oxy-1,13-dimethyl-21-oxa-15-azatetracyclo[16.2.1.05,20.08,19]henicosa-3,6,9,11-tetraen-16-one |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C26H36N2O6/c1-14-5-3-4-6-15-7-8-16-9-10-19(33-25-23(27)24(31)17(29)13-32-25)26(2)22(16)21(15)18(34-26)11-20(30)28-12-14/h3-10,14-19,21-25,29,31H,11-13,27H2,1-2H3,(H,28,30)/b5-3-,6-4+/t14-,15-,16-,17-,18-,19+,21-,22+,23-,24+,25+,26+/m0/s1 |
| InChI Key | PMOMCJMPRBACKS-LBACZXMASA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C26H36N2O6 |
| Molecular Weight | 472.60 g/mol |
| Exact Mass | 472.25733687 g/mol |
| Topological Polar Surface Area (TPSA) | 123.00 Ų |
| XlogP | 0.60 |
| 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 | 99.11% | 91.11% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 98.64% | 96.09% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 97.63% | 94.45% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 95.45% | 97.25% |
| CHEMBL1907605 | P24864 | Cyclin-dependent kinase 2/cyclin E1 | 94.69% | 92.88% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 94.06% | 97.09% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 92.05% | 85.14% |
| CHEMBL4303 | P08238 | Heat shock protein HSP 90-beta | 90.29% | 96.77% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 89.88% | 95.56% |
| CHEMBL2581 | P07339 | Cathepsin D | 89.68% | 98.95% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 88.78% | 94.00% |
| CHEMBL241 | Q14432 | Phosphodiesterase 3A | 88.77% | 92.94% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 87.64% | 86.33% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 86.06% | 95.89% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 85.81% | 90.00% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 85.67% | 100.00% |
| CHEMBL218 | P21554 | Cannabinoid CB1 receptor | 83.25% | 96.61% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 83.24% | 89.00% |
| CHEMBL4040 | P28482 | MAP kinase ERK2 | 83.14% | 83.82% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 82.98% | 94.73% |
| CHEMBL2007 | P16234 | Platelet-derived growth factor receptor alpha | 82.68% | 91.07% |
| CHEMBL226 | P30542 | Adenosine A1 receptor | 81.95% | 95.93% |
| CHEMBL255 | P29275 | Adenosine A2b receptor | 81.31% | 98.59% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 81.29% | 99.23% |
| CHEMBL3713062 | P10646 | Tissue factor pathway inhibitor | 81.20% | 97.33% |
| CHEMBL2094127 | P06493 | Cyclin-dependent kinase 1/cyclin B | 80.98% | 96.00% |
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 | 132821223 |
| LOTUS | LTS0135349 |
| wikiData | Q105211626 |