(+/-)-Laureline
| Internal ID | 3ab05469-c138-48a0-a1b6-d0dc96965afb |
| Taxonomy | Alkaloids and derivatives > Aporphines |
| IUPAC Name | 17-methoxy-11-methyl-3,5-dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1(20),2(6),7,14(19),15,17-hexaene |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C19H19NO3/c1-20-6-5-12-8-16-19(23-10-22-16)18-14-9-13(21-2)4-3-11(14)7-15(20)17(12)18/h3-4,8-9,15H,5-7,10H2,1-2H3 |
| InChI Key | CXHXSNCRZOIVQW-UHFFFAOYSA-N |
| Popularity | 40 references in papers |
| Molecular Formula | C19H19NO3 |
| Molecular Weight | 309.40 g/mol |
| Exact Mass | 309.13649347 g/mol |
| Topological Polar Surface Area (TPSA) | 30.90 Ų |
| XlogP | 3.30 |
| Laureline, (+/-)- |
| Laureline (+/-)-form [MI] |
| UNII-904HE78XI2 |
| 904HE78XI2 |
| 10-Methoxy-1,2-(methylenedioxy)aporphine, (+/-)- |
| 3749-97-1 |
| 5H-Benzo(g)-1,3-benzodioxolo(6,5,4-de)quinoline, 6,7,7a,8-tetrahydro-11-methoxy-7-methyl- |
| Lanreline |
| SCHEMBL29787226 |
| CXHXSNCRZOIVQW-UHFFFAOYSA-N |
| There are more than 10 synonyms. If you wish to see them all click here. |
| 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 |
|---|---|---|---|---|
| CHEMBL4303 | P08238 | Heat shock protein HSP 90-beta | 99.15% | 96.77% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 98.62% | 96.09% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 95.73% | 91.49% |
| CHEMBL5697 | Q9GZT9 | Egl nine homolog 1 | 95.38% | 93.40% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 94.27% | 91.11% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 94.25% | 95.56% |
| CHEMBL240 | Q12809 | HERG | 94.19% | 89.76% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 93.49% | 90.00% |
| CHEMBL2056 | P21728 | Dopamine D1 receptor | 91.71% | 91.00% |
| CHEMBL2581 | P07339 | Cathepsin D | 91.33% | 98.95% |
| CHEMBL2373 | P21730 | C5a anaphylatoxin chemotactic receptor | 90.74% | 92.62% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 90.66% | 95.89% |
| CHEMBL3192 | Q9BY41 | Histone deacetylase 8 | 90.48% | 93.99% |
| CHEMBL3438 | Q05513 | Protein kinase C zeta | 89.63% | 88.48% |
| CHEMBL2041 | P07949 | Tyrosine-protein kinase receptor RET | 89.24% | 91.79% |
| CHEMBL4895 | P30530 | Tyrosine-protein kinase receptor UFO | 87.72% | 90.95% |
| CHEMBL5311 | P37023 | Serine/threonine-protein kinase receptor R3 | 87.47% | 82.67% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 87.21% | 86.33% |
| CHEMBL4247 | Q9UM73 | ALK tyrosine kinase receptor | 86.56% | 96.86% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 86.40% | 94.00% |
| CHEMBL5339 | Q5NUL3 | G-protein coupled receptor 120 | 84.86% | 95.78% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 84.52% | 97.09% |
| CHEMBL2335 | P42785 | Lysosomal Pro-X carboxypeptidase | 82.88% | 100.00% |
| CHEMBL3820 | P35557 | Hexokinase type IV | 82.80% | 91.96% |
| CHEMBL2069156 | Q14145 | Kelch-like ECH-associated protein 1 | 82.37% | 82.38% |
| CHEMBL4940 | P07195 | L-lactate dehydrogenase B chain | 82.23% | 95.53% |
| CHEMBL1907603 | Q05586 | Glutamate NMDA receptor; GRIN1/GRIN2B | 82.04% | 95.89% |
| CHEMBL5469 | Q14289 | Protein tyrosine kinase 2 beta | 81.94% | 91.03% |
| CHEMBL2146302 | O94925 | Glutaminase kidney isoform, mitochondrial | 81.00% | 100.00% |
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.
| Hedycarya angustifolia |
| Laurelia novae-zelandiae |
| PubChem | 628058 |
| LOTUS | LTS0077914 |
| wikiData | Q27271282 |