Chrondamide 12D
| Internal ID | 80dacdc7-6304-40f8-a248-ef5e9b660beb |
| Taxonomy | Organic acids and derivatives > Peptidomimetics > Hybrid peptides |
| IUPAC Name | (7R,10S,13S,15Z,17S,18R)-18-ethyl-4-(4-hydroxyphenyl)-7-(1H-indol-3-ylmethyl)-8,10,13,15,17-pentamethyl-1-oxa-5,8,11-triazacyclooctadec-15-ene-2,6,9,12-tetrone |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C36H46N4O6/c1-7-32-22(3)16-21(2)17-23(4)34(43)38-24(5)36(45)40(6)31(18-26-20-37-29-11-9-8-10-28(26)29)35(44)39-30(19-33(42)46-32)25-12-14-27(41)15-13-25/h8-16,20,22-24,30-32,37,41H,7,17-19H2,1-6H3,(H,38,43)(H,39,44)/b21-16-/t22-,23-,24-,30?,31+,32+/m0/s1 |
| InChI Key | BKPURKGQNCWTQZ-FRLYFJJMSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C36H46N4O6 |
| Molecular Weight | 630.80 g/mol |
| Exact Mass | 630.34173520 g/mol |
| Topological Polar Surface Area (TPSA) | 141.00 Ų |
| XlogP | 4.80 |
| 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 |
|---|---|---|---|---|
| CHEMBL2581 | P07339 | Cathepsin D | 99.05% | 98.95% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 98.66% | 91.11% |
| CHEMBL5103 | Q969S8 | Histone deacetylase 10 | 96.96% | 90.08% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 96.65% | 95.56% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 96.29% | 99.23% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 95.50% | 89.00% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 95.50% | 96.09% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 95.33% | 97.09% |
| CHEMBL3310 | Q96DB2 | Histone deacetylase 11 | 94.78% | 88.56% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 94.69% | 85.14% |
| CHEMBL2996 | Q05655 | Protein kinase C delta | 93.41% | 97.79% |
| CHEMBL255 | P29275 | Adenosine A2b receptor | 90.93% | 98.59% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 90.19% | 91.49% |
| CHEMBL2288 | Q13526 | Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 | 89.73% | 91.71% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 89.37% | 97.25% |
| CHEMBL2095226 | P05556 | Integrin alpha-5/beta-1 | 88.71% | 96.39% |
| CHEMBL4040 | P28482 | MAP kinase ERK2 | 87.80% | 83.82% |
| CHEMBL1949 | P62937 | Cyclophilin A | 86.68% | 98.57% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 86.34% | 94.00% |
| CHEMBL5966 | P55899 | IgG receptor FcRn large subunit p51 | 83.48% | 90.93% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 82.81% | 94.73% |
| CHEMBL2693 | Q9UIQ6 | Cystinyl aminopeptidase | 82.64% | 97.64% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 82.57% | 86.33% |
| CHEMBL215 | P09917 | Arachidonate 5-lipoxygenase | 82.22% | 92.68% |
| CHEMBL3155 | P34969 | Serotonin 7 (5-HT7) receptor | 82.10% | 90.71% |
| CHEMBL3004 | P33527 | Multidrug resistance-associated protein 1 | 81.08% | 96.37% |
| CHEMBL2069156 | Q14145 | Kelch-like ECH-associated protein 1 | 80.42% | 82.38% |
| CHEMBL213 | P08588 | Beta-1 adrenergic receptor | 80.15% | 95.56% |
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 | 139587559 |
| LOTUS | LTS0123743 |
| wikiData | Q77569112 |