Stambomycin C
| Internal ID | 010542a7-580b-4212-891a-eb39d07269e6 |
| Taxonomy | Organic oxygen compounds > Organooxygen compounds > Carbohydrates and carbohydrate conjugates > Aminosaccharides > Aminoglycosides |
| IUPAC Name | (6Z,30Z,42Z,44Z)-50-[(2R,3R,4S,5S,6R)-4-(dimethylamino)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-1,8,10,14,16,20,22,24,27,28,32,34,38,40,46-pentadecahydroxy-5,15,19,31,39,45,47,51-octamethyl-29-(4-methylpentyl)-4,52-dioxabicyclo[46.3.1]dopentaconta-6,30,42,44-tetraen-3-one |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C72H131NO22/c1-40(2)19-16-21-50-33-43(5)62(85)36-52(75)23-18-26-57(80)45(7)56(79)24-15-14-20-42(4)67(87)47(9)63-38-64(94-71-70(90)66(73(12)13)68(88)49(11)93-71)48(10)72(91,95-63)39-65(86)92-44(6)28-29-53(76)34-51(74)22-17-25-58(81)46(8)59(82)31-27-41(3)61(84)37-55(78)35-54(77)30-32-60(83)69(50)89/h14-15,20,28-29,33,40-41,44-64,66-71,74-85,87-91H,16-19,21-27,30-32,34-39H2,1-13H3/b15-14-,29-28-,42-20-,43-33-/t41?,44?,45?,46?,47?,48?,49-,50?,51?,52?,53?,54?,55?,56?,57?,58?,59?,60?,61?,62?,63?,64?,66+,67?,68-,69?,70-,71+,72?/m1/s1 |
| InChI Key | HNOXBWUDARWQCR-VFVCWLINSA-N |
| Popularity | 3 references in papers |
| Molecular Formula | C72H131NO22 |
| Molecular Weight | 1362.80 g/mol |
| Exact Mass | 1361.91627481 g/mol |
| Topological Polar Surface Area (TPSA) | 401.00 Ų |
| XlogP | 4.30 |
| 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 |
|---|---|---|---|---|
| CHEMBL4303 | P08238 | Heat shock protein HSP 90-beta | 98.66% | 96.77% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 95.74% | 91.11% |
| CHEMBL226 | P30542 | Adenosine A1 receptor | 95.68% | 95.93% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 94.85% | 95.56% |
| CHEMBL2581 | P07339 | Cathepsin D | 94.84% | 98.95% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 93.83% | 96.09% |
| CHEMBL3359 | P21462 | Formyl peptide receptor 1 | 92.53% | 93.56% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 92.52% | 97.09% |
| CHEMBL3837 | P07711 | Cathepsin L | 92.31% | 96.61% |
| CHEMBL3145 | P42338 | PI3-kinase p110-beta subunit | 92.04% | 98.75% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 91.76% | 94.73% |
| CHEMBL4685 | P14902 | Indoleamine 2,3-dioxygenase | 91.72% | 96.38% |
| CHEMBL240 | Q12809 | HERG | 91.53% | 89.76% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 91.50% | 94.45% |
| CHEMBL5103 | Q969S8 | Histone deacetylase 10 | 91.12% | 90.08% |
| CHEMBL2007 | P16234 | Platelet-derived growth factor receptor alpha | 89.43% | 91.07% |
| CHEMBL2335 | P42785 | Lysosomal Pro-X carboxypeptidase | 89.28% | 100.00% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 88.90% | 95.89% |
| CHEMBL5163 | Q9NY46 | Sodium channel protein type III alpha subunit | 88.79% | 96.90% |
| CHEMBL1907603 | Q05586 | Glutamate NMDA receptor; GRIN1/GRIN2B | 87.89% | 95.89% |
| CHEMBL2563 | Q9UQL6 | Histone deacetylase 5 | 86.19% | 89.67% |
| CHEMBL4835 | P00338 | L-lactate dehydrogenase A chain | 85.71% | 95.34% |
| CHEMBL5469 | Q14289 | Protein tyrosine kinase 2 beta | 85.63% | 91.03% |
| CHEMBL1907600 | Q00535 | Cyclin-dependent kinase 5/CDK5 activator 1 | 84.68% | 93.03% |
| CHEMBL1871 | P10275 | Androgen Receptor | 83.91% | 96.43% |
| CHEMBL3130 | O00329 | PI3-kinase p110-delta subunit | 83.79% | 96.47% |
| CHEMBL344 | Q99705 | Melanin-concentrating hormone receptor 1 | 83.46% | 92.50% |
| CHEMBL3267 | P48736 | PI3-kinase p110-gamma subunit | 82.53% | 95.71% |
| CHEMBL4227 | P25090 | Lipoxin A4 receptor | 82.38% | 100.00% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 82.15% | 86.33% |
| CHEMBL2959 | Q08881 | Tyrosine-protein kinase ITK/TSK | 82.13% | 95.00% |
| CHEMBL1937 | Q92769 | Histone deacetylase 2 | 81.47% | 94.75% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 81.18% | 89.00% |
| CHEMBL3004 | P33527 | Multidrug resistance-associated protein 1 | 81.11% | 96.37% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 80.88% | 94.00% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 80.80% | 90.71% |
| CHEMBL230 | P35354 | Cyclooxygenase-2 | 80.66% | 89.63% |
| CHEMBL2664 | P23526 | Adenosylhomocysteinase | 80.54% | 86.67% |
| CHEMBL1907605 | P24864 | Cyclin-dependent kinase 2/cyclin E1 | 80.51% | 92.88% |
| CHEMBL4478 | Q00975 | Voltage-gated N-type calcium channel alpha-1B subunit | 80.49% | 97.14% |
| CHEMBL2373 | P21730 | C5a anaphylatoxin chemotactic receptor | 80.23% | 92.62% |
| CHEMBL4105838 | Q96GG9 | DCN1-like protein 1 | 80.23% | 95.00% |
| CHEMBL4803 | P29474 | Nitric-oxide synthase, endothelial | 80.23% | 86.00% |
Below are displayed all the plants proven (via scientific papers) to contain this
compound!
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| There are no matching plants. |
| PubChem | 102365383 |
| LOTUS | LTS0229481 |
| wikiData | Q105030991 |