Anabaenolysin C
| Internal ID | 0117e6da-68e0-4a7f-ab72-474ac8a7a85f |
| Taxonomy | Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Peptides > Cyclic peptides |
| IUPAC Name | 3-[(11S)-4,14-dihydroxy-3,7,10,13,17-pentaoxo-5-[(2E,4E,6E)-pentadeca-2,4,6,14-tetraenyl]-16-oxa-2,6,9,12-tetrazabicyclo[13.3.0]octadecan-11-yl]propanamide |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C31H45N5O9/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-26(40)30(43)36-22-18-25(39)45-28(22)27(41)31(44)35-21(16-17-23(32)37)29(42)33-19-24(38)34-20/h2,9-14,20-22,26-28,40-41H,1,3-8,15-19H2,(H2,32,37)(H,33,42)(H,34,38)(H,35,44)(H,36,43)/b10-9+,12-11+,14-13+/t20?,21-,22?,26?,27?,28?/m0/s1 |
| InChI Key | LRCNGMYPFPDQLQ-IYYVNUIDSA-N |
| Popularity | 3 references in papers |
| Molecular Formula | C31H45N5O9 |
| Molecular Weight | 631.70 g/mol |
| Exact Mass | 631.32172803 g/mol |
| Topological Polar Surface Area (TPSA) | 226.00 Ų |
| XlogP | 0.90 |
| 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 |
|---|---|---|---|---|
| CHEMBL4040 | P28482 | MAP kinase ERK2 | 99.88% | 83.82% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 98.41% | 91.11% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 94.76% | 94.45% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 93.44% | 99.17% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 92.53% | 96.09% |
| CHEMBL241 | Q14432 | Phosphodiesterase 3A | 92.51% | 92.94% |
| CHEMBL4588 | P22894 | Matrix metalloproteinase 8 | 91.19% | 94.66% |
| CHEMBL299 | P17252 | Protein kinase C alpha | 88.91% | 98.03% |
| CHEMBL2581 | P07339 | Cathepsin D | 87.65% | 98.95% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 87.48% | 97.09% |
| CHEMBL2208 | P49137 | MAP kinase-activated protein kinase 2 | 86.81% | 95.20% |
| CHEMBL1902 | P62942 | FK506-binding protein 1A | 86.42% | 97.05% |
| CHEMBL4187 | Q99250 | Sodium channel protein type II alpha subunit | 86.16% | 95.50% |
| CHEMBL5103 | Q969S8 | Histone deacetylase 10 | 85.24% | 90.08% |
| CHEMBL3807 | P17706 | T-cell protein-tyrosine phosphatase | 85.06% | 93.00% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 84.95% | 89.00% |
| CHEMBL217 | P14416 | Dopamine D2 receptor | 83.65% | 95.62% |
| CHEMBL2996 | Q05655 | Protein kinase C delta | 82.82% | 97.79% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 81.94% | 95.89% |
| CHEMBL221 | P23219 | Cyclooxygenase-1 | 81.66% | 90.17% |
| CHEMBL4530 | P00488 | Coagulation factor XIII | 81.27% | 96.00% |
| CHEMBL2274 | Q9H228 | Sphingosine 1-phosphate receptor Edg-8 | 81.09% | 100.00% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 80.98% | 90.71% |
| CHEMBL4227 | P25090 | Lipoxin A4 receptor | 80.68% | 100.00% |
| CHEMBL1293267 | Q9HC97 | G-protein coupled receptor 35 | 80.30% | 89.34% |
| CHEMBL220 | P22303 | Acetylcholinesterase | 80.05% | 94.45% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 80.00% | 99.23% |
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 | 146683717 |
| LOTUS | LTS0047104 |
| wikiData | Q105156059 |