17-Methoxy-5,7-dioxa-12-azapentacyclo[10.6.1.02,10.04,8.015,19]nonadeca-2,4(8),9,16-tetraen-18-ol
Internal ID | cbca0f68-fa52-4bee-9a4a-e6145fcdd092 |
Taxonomy | Alkaloids and derivatives > Amaryllidaceae alkaloids > Lycorine-type amaryllidaceae alkaloids |
IUPAC Name | 17-methoxy-5,7-dioxa-12-azapentacyclo[10.6.1.02,10.04,8.015,19]nonadeca-2,4(8),9,16-tetraen-18-ol |
SMILES (Canonical) | COC1=CC2CCN3C2C(C1O)C4=CC5=C(C=C4C3)OCO5 |
SMILES (Isomeric) | COC1=CC2CCN3C2C(C1O)C4=CC5=C(C=C4C3)OCO5 |
InChI | InChI=1S/C17H19NO4/c1-20-14-4-9-2-3-18-7-10-5-12-13(22-8-21-12)6-11(10)15(16(9)18)17(14)19/h4-6,9,15-17,19H,2-3,7-8H2,1H3 |
InChI Key | FKVRMQNEWFZVGO-UHFFFAOYSA-N |
Popularity | 0 references in papers |
Molecular Formula | C17H19NO4 |
Molecular Weight | 301.34 g/mol |
Exact Mass | 301.13140809 g/mol |
Topological Polar Surface Area (TPSA) | 51.20 Ų |
XlogP | 1.10 |
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 |
---|---|---|---|---|
CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 96.89% | 96.09% |
CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 95.11% | 91.11% |
CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 94.81% | 94.45% |
CHEMBL4303 | P08238 | Heat shock protein HSP 90-beta | 92.67% | 96.77% |
CHEMBL2581 | P07339 | Cathepsin D | 91.31% | 98.95% |
CHEMBL2781 | P19634 | Sodium/hydrogen exchanger 1 | 89.31% | 90.24% |
CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 88.51% | 95.89% |
CHEMBL1907603 | Q05586 | Glutamate NMDA receptor; GRIN1/GRIN2B | 87.48% | 95.89% |
CHEMBL2373 | P21730 | C5a anaphylatoxin chemotactic receptor | 87.14% | 92.62% |
CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 87.07% | 86.33% |
CHEMBL4225 | P49760 | Dual specificity protein kinase CLK2 | 86.28% | 80.96% |
CHEMBL5311 | P37023 | Serine/threonine-protein kinase receptor R3 | 85.50% | 82.67% |
CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 84.29% | 89.00% |
CHEMBL225 | P28335 | Serotonin 2c (5-HT2c) receptor | 81.94% | 89.62% |
CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 81.03% | 85.14% |
CHEMBL1994 | P08235 | Mineralocorticoid receptor | 80.35% | 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.
Amaryllis belladonna |
PubChem | 85093932 |
LOTUS | LTS0186697 |
wikiData | Q104996839 |