Nocardiamide B
| Internal ID | b2f75990-476a-4f10-926a-03678f951a9a |
| Taxonomy | Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Peptides > Oligopeptides |
| IUPAC Name | (3S,6S,9R,12R,15S,18R)-3-[(4-hydroxyphenyl)methyl]-9-(2-methylpropyl)-6,12,15,18-tetra(propan-2-yl)-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-hexone |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C35H56N6O7/c1-17(2)15-24-30(43)38-26(18(3)4)32(45)37-25(16-22-11-13-23(42)14-12-22)31(44)39-28(20(7)8)34(47)41-29(21(9)10)35(48)40-27(19(5)6)33(46)36-24/h11-14,17-21,24-29,42H,15-16H2,1-10H3,(H,36,46)(H,37,45)(H,38,43)(H,39,44)(H,40,48)(H,41,47)/t24-,25+,26+,27-,28-,29+/m1/s1 |
| InChI Key | LGEXLQQDCZMCOX-VRZSYJHESA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C35H56N6O7 |
| Molecular Weight | 672.90 g/mol |
| Exact Mass | 672.42104815 g/mol |
| Topological Polar Surface Area (TPSA) | 195.00 Ų |
| XlogP | 4.90 |
| CHEMBL2333564 |
| 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 | 98.98% | 98.95% |
| CHEMBL4040 | P28482 | MAP kinase ERK2 | 96.27% | 83.82% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 95.42% | 94.45% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 94.97% | 96.09% |
| CHEMBL5103 | Q969S8 | Histone deacetylase 10 | 94.28% | 90.08% |
| CHEMBL1937 | Q92769 | Histone deacetylase 2 | 93.99% | 94.75% |
| CHEMBL5966 | P55899 | IgG receptor FcRn large subunit p51 | 93.68% | 90.93% |
| CHEMBL2563 | Q9UQL6 | Histone deacetylase 5 | 92.33% | 89.67% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 91.38% | 91.11% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 88.25% | 95.56% |
| CHEMBL1907594 | P30926 | Neuronal acetylcholine receptor; alpha3/beta4 | 87.82% | 97.23% |
| CHEMBL1907603 | Q05586 | Glutamate NMDA receptor; GRIN1/GRIN2B | 86.63% | 95.89% |
| CHEMBL1949 | P62937 | Cyclophilin A | 86.59% | 98.57% |
| CHEMBL5852 | Q96P65 | Pyroglutamylated RFamide peptide receptor | 85.96% | 85.00% |
| CHEMBL5896 | O75164 | Lysine-specific demethylase 4A | 85.94% | 99.09% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 85.50% | 85.14% |
| CHEMBL242 | Q92731 | Estrogen receptor beta | 85.15% | 98.35% |
| CHEMBL3830 | Q2M2I8 | Adaptor-associated kinase | 83.81% | 83.10% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 83.58% | 97.09% |
| CHEMBL2996 | Q05655 | Protein kinase C delta | 82.80% | 97.79% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 81.77% | 90.71% |
| CHEMBL3310 | Q96DB2 | Histone deacetylase 11 | 81.08% | 88.56% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 80.54% | 97.25% |
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 | 71665771 |
| LOTUS | LTS0070420 |
| wikiData | Q77572085 |