Pamamycin-635B
| Internal ID | 384313b5-a78b-4a7a-9f3e-fdf9f28bfe2e |
| Taxonomy | Phenylpropanoids and polyketides > Macrolides and analogues |
| IUPAC Name | (1R,2S,5S,6R,7S,10R,11R,14S,15R,16S)-5-[(1R)-1-[(2R,5S)-5-[(2R)-2-(dimethylamino)pentyl]oxolan-2-yl]ethyl]-2-ethyl-6,11,15-trimethyl-14-propyl-4,13,19,20-tetraoxatricyclo[14.2.1.17,10]icosane-3,12-dione |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C37H65NO7/c1-10-13-26(38(8)9)21-27-15-16-31(41-27)23(5)35-24(6)32-17-18-33(42-32)25(7)36(39)44-29(14-11-2)22(4)30-19-20-34(43-30)28(12-3)37(40)45-35/h22-35H,10-21H2,1-9H3/t22-,23+,24+,25+,26+,27-,28-,29-,30-,31+,32-,33+,34+,35-/m0/s1 |
| InChI Key | YKCUFYKQBDKOTO-ZQNVBORHSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C37H65NO7 |
| Molecular Weight | 635.90 g/mol |
| Exact Mass | 635.47610341 g/mol |
| Topological Polar Surface Area (TPSA) | 83.50 Ų |
| XlogP | 8.00 |
| SCHEMBL29884220 |
| CHEBI:203604 |
| (1R,2S,5S,6R,7S,10R,11R,14S,15R,16S)-5-[(1R)-1-[(2R,5S)-5-[(2R)-2-(dimethylamino)pentyl]oxolan-2-yl]ethyl]-2-ethyl-6,11,15-trimethyl-14-propyl-4,13,19,20-tetraoxatricyclo[14.2.1.17,10]icosane-3,12-dione |
| 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 |
|---|---|---|---|---|
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 96.52% | 96.09% |
| CHEMBL2581 | P07339 | Cathepsin D | 95.68% | 98.95% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 95.62% | 97.25% |
| CHEMBL255 | P29275 | Adenosine A2b receptor | 90.17% | 98.59% |
| CHEMBL4105838 | Q96GG9 | DCN1-like protein 1 | 89.14% | 95.00% |
| CHEMBL3130 | O00329 | PI3-kinase p110-delta subunit | 88.05% | 96.47% |
| CHEMBL3807 | P17706 | T-cell protein-tyrosine phosphatase | 87.46% | 93.00% |
| CHEMBL221 | P23219 | Cyclooxygenase-1 | 87.20% | 90.17% |
| CHEMBL274 | P51681 | C-C chemokine receptor type 5 | 86.54% | 98.77% |
| CHEMBL4072 | P07858 | Cathepsin B | 85.61% | 93.67% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 84.19% | 90.71% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 83.90% | 94.73% |
| CHEMBL4588 | P22894 | Matrix metalloproteinase 8 | 83.70% | 94.66% |
| CHEMBL4685 | P14902 | Indoleamine 2,3-dioxygenase | 83.31% | 96.38% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 82.78% | 97.09% |
| CHEMBL1795139 | Q8IU80 | Transmembrane protease serine 6 | 82.24% | 98.33% |
| CHEMBL4303 | P08238 | Heat shock protein HSP 90-beta | 82.08% | 96.77% |
| CHEMBL3880 | P07900 | Heat shock protein HSP 90-alpha | 82.05% | 96.21% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 81.31% | 91.11% |
| CHEMBL220 | P22303 | Acetylcholinesterase | 80.84% | 94.45% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 80.70% | 89.00% |
| CHEMBL2094135 | Q96BI3 | Gamma-secretase | 80.19% | 98.05% |
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 | 15694391 |
| LOTUS | LTS0046672 |
| wikiData | Q77379211 |