Microgrewiapine A
| Internal ID | 7cc895f2-6cf0-4db6-9f68-97ba226d8127 |
| Taxonomy | Organoheterocyclic compounds > Piperidines |
| IUPAC Name | (2S,3R,6S)-6-[(1E,3E,5E)-deca-1,3,5-trienyl]-1,2-dimethylpiperidin-3-ol |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C17H29NO/c1-4-5-6-7-8-9-10-11-12-16-13-14-17(19)15(2)18(16)3/h7-12,15-17,19H,4-6,13-14H2,1-3H3/b8-7+,10-9+,12-11+/t15-,16+,17+/m0/s1 |
| InChI Key | ZBJGGLXQNXXXRO-VCZRHBNQSA-N |
| Popularity | 3 references in papers |
| Molecular Formula | C17H29NO |
| Molecular Weight | 263.40 g/mol |
| Exact Mass | 263.224914549 g/mol |
| Topological Polar Surface Area (TPSA) | 23.50 Ų |
| XlogP | 4.30 |
| (2S,3R,6S)-6-((1E,3E,5E)-deca-1,3,5-trienyl)-1,2-dimethylpiperidin-3-ol |
| (2S,3R,6S)-6-[(1E,3E,5E)-deca-1,3,5-trienyl]-1,2-dimethylpiperidin-3-ol |
| RefChem:925862 |
| 1420777-30-5 |
| orb1680251 |
| CHEMBL2334868 |
| HY-N10132 |
| AKOS040763515 |
| DA-65451 |
| CS-0311188 |
| 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 | 96.42% | 98.95% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 94.48% | 96.09% |
| CHEMBL6136 | O60341 | Lysine-specific histone demethylase 1 | 93.53% | 95.58% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 90.85% | 97.25% |
| CHEMBL2730 | P21980 | Protein-glutamine gamma-glutamyltransferase | 90.29% | 92.38% |
| CHEMBL2955 | O95136 | Sphingosine 1-phosphate receptor Edg-5 | 88.52% | 92.86% |
| CHEMBL4072 | P07858 | Cathepsin B | 88.45% | 93.67% |
| CHEMBL3359 | P21462 | Formyl peptide receptor 1 | 87.54% | 93.56% |
| CHEMBL2265 | P23141 | Acyl coenzyme A:cholesterol acyltransferase | 86.96% | 85.94% |
| CHEMBL2274 | Q9H228 | Sphingosine 1-phosphate receptor Edg-8 | 86.71% | 100.00% |
| CHEMBL226 | P30542 | Adenosine A1 receptor | 86.61% | 95.93% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 86.42% | 99.17% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 85.74% | 97.09% |
| CHEMBL1795139 | Q8IU80 | Transmembrane protease serine 6 | 83.13% | 98.33% |
| CHEMBL2781 | P19634 | Sodium/hydrogen exchanger 1 | 82.09% | 90.24% |
| CHEMBL2001 | Q9H244 | Purinergic receptor P2Y12 | 81.79% | 96.00% |
| CHEMBL4227 | P25090 | Lipoxin A4 receptor | 81.45% | 100.00% |
| CHEMBL5043 | Q6P179 | Endoplasmic reticulum aminopeptidase 2 | 81.16% | 91.81% |
| CHEMBL268 | P43235 | Cathepsin K | 80.14% | 96.85% |
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.
| Microcos paniculata |
| PubChem | 71576920 |
| NPASS | NPC23721 |
| ChEMBL | CHEMBL2334868 |
| LOTUS | LTS0076526 |
| wikiData | Q105370644 |