1,2,9,10-Tetramethoxy-6,7-dimethyl-5,6-dihydro-4h-dibenzo[de,g]quinoline

Details

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Internal ID aedb0bf9-6235-49ea-9f6c-deca2c0266d2
Taxonomy Alkaloids and derivatives > Aporphines
IUPAC Name 4,5,15,16-tetramethoxy-8,10-dimethyl-10-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2,4,6,8,13,15-heptaene
SMILES (Canonical) CC1=C2C3=C(C4=CC(=C(C=C14)OC)OC)C(=C(C=C3CCN2C)OC)OC
SMILES (Isomeric) CC1=C2C3=C(C4=CC(=C(C=C14)OC)OC)C(=C(C=C3CCN2C)OC)OC
InChI InChI=1S/C22H25NO4/c1-12-14-10-16(24-3)17(25-4)11-15(14)20-19-13(7-8-23(2)21(12)19)9-18(26-5)22(20)27-6/h9-11H,7-8H2,1-6H3
InChI Key RBCAXOSUUINIHP-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C22H25NO4
Molecular Weight 367.40 g/mol
Exact Mass 367.17835828 g/mol
Topological Polar Surface Area (TPSA) 40.20 Ų
XlogP 4.80

Synonyms

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SCHEMBL14029531
1,2,9,10-tetramethoxy-6,7-dimethyl-5,6-dihydro-4h-dibenzo[de,g]quinoline
AKOS024282945
NCGC00142569-01
Q63399172

2D Structure

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2D Structure of 1,2,9,10-Tetramethoxy-6,7-dimethyl-5,6-dihydro-4h-dibenzo[de,g]quinoline

3D Structure

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ADMET Properties (via admetSAR 2)

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Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

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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
CHEMBL4302 P08183 P-glycoprotein 1 95.29% 92.98%
CHEMBL3192 Q9BY41 Histone deacetylase 8 95.20% 93.99%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 94.67% 96.09%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 93.27% 94.00%
CHEMBL1913 P09619 Platelet-derived growth factor receptor beta 93.22% 95.70%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 92.51% 95.56%
CHEMBL5747 Q92793 CREB-binding protein 90.53% 95.12%
CHEMBL2056 P21728 Dopamine D1 receptor 90.46% 91.00%
CHEMBL1293249 Q13887 Kruppel-like factor 5 89.60% 86.33%
CHEMBL241 Q14432 Phosphodiesterase 3A 89.56% 92.94%
CHEMBL4208 P20618 Proteasome component C5 88.36% 90.00%
CHEMBL1871 P10275 Androgen Receptor 87.50% 96.43%
CHEMBL4835 P00338 L-lactate dehydrogenase A chain 85.31% 95.34%
CHEMBL5608 Q16288 NT-3 growth factor receptor 85.10% 95.89%
CHEMBL5409 Q8TDU6 G-protein coupled bile acid receptor 1 85.02% 93.65%
CHEMBL2535 P11166 Glucose transporter 84.17% 98.75%
CHEMBL5925 P22413 Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 82.46% 92.38%
CHEMBL1806 P11388 DNA topoisomerase II alpha 82.37% 89.00%
CHEMBL1868 P17948 Vascular endothelial growth factor receptor 1 82.01% 96.47%
CHEMBL6031 Q9H9B1 Histone-lysine N-methyltransferase, H3 lysine-9 specific 5 81.54% 94.33%
CHEMBL2069156 Q14145 Kelch-like ECH-associated protein 1 80.68% 82.38%

Plants that contains it

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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.
Corydalis turtschaninovii

Cross-Links

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PubChem 53073
LOTUS LTS0087200
wikiData Q63399172