12-Hydroxy-14-(1-hydroxyethyl)-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadeca-2,4-dien-6-one
| Internal ID | c296de61-c62d-4167-91cd-076d8b0268af |
| Taxonomy | Alkaloids and derivatives > Lupin alkaloids > Anagyrine-type alkaloids |
| IUPAC Name | 12-hydroxy-14-(1-hydroxyethyl)-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadeca-2,4-dien-6-one |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C17H24N2O3/c1-10(20)15-6-13(21)7-16-12-5-11(8-18(15)16)14-3-2-4-17(22)19(14)9-12/h2-4,10-13,15-16,20-21H,5-9H2,1H3 |
| InChI Key | ZVYNJRZSHUMWHS-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C17H24N2O3 |
| Molecular Weight | 304.40 g/mol |
| Exact Mass | 304.17869263 g/mol |
| Topological Polar Surface Area (TPSA) | 64.00 Ų |
| XlogP | 0.40 |
| There are no found synonyms. |
![2D Structure of 12-Hydroxy-14-(1-hydroxyethyl)-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadeca-2,4-dien-6-one](https://plantaedb.com/storage/docs/compounds/2023/11/12-hydroxy-14-1-hydroxyethyl-715-diazatetracyclo77102701015heptadeca-24-dien-6-one.jpg "2D Structure of 12-Hydroxy-14-(1-hydroxyethyl)-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadeca-2,4-dien-6-one")
| 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 | 98.65% | 98.95% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 96.60% | 96.09% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 92.99% | 95.56% |
| CHEMBL1907588 | P02708 | Acetylcholine receptor; alpha1/beta1/delta/gamma | 91.94% | 98.33% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 89.56% | 99.23% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 88.27% | 97.09% |
| CHEMBL1907598 | P05106 | Integrin alpha-V/beta-3 | 88.18% | 95.71% |
| CHEMBL4040 | P28482 | MAP kinase ERK2 | 86.76% | 83.82% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 86.16% | 94.45% |
| CHEMBL4478 | Q00975 | Voltage-gated N-type calcium channel alpha-1B subunit | 84.11% | 97.14% |
| CHEMBL4026 | P40763 | Signal transducer and activator of transcription 3 | 82.88% | 82.69% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 82.42% | 90.71% |
| CHEMBL3359 | P21462 | Formyl peptide receptor 1 | 80.99% | 93.56% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 80.33% | 89.00% |
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.
| Cabari glaucophylla |
| PubChem | 73201095 |
| LOTUS | LTS0082826 |
| wikiData | Q105384758 |