10-methoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-9-ol

Details

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Internal ID 8bca72d1-e0ff-4829-a7db-8dc40a0e7f07
Taxonomy Alkaloids and derivatives > Aporphines
IUPAC Name 10-methoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-9-ol
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C18H19NO2/c1-19-7-6-11-4-3-5-13-14-10-17(21-2)16(20)9-12(14)8-15(19)18(11)13/h3-5,9-10,15,20H,6-8H2,1-2H3
InChI Key CRSMCADHSFQBLA-UHFFFAOYSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C18H19NO2
Molecular Weight 281.30 g/mol
Exact Mass 281.141578849 g/mol
Topological Polar Surface Area (TPSA) 32.70 Ų
XlogP 2.60

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 10-methoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-9-ol

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
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 99.28% 96.09%
CHEMBL217 P14416 Dopamine D2 receptor 97.27% 95.62%
CHEMBL2056 P21728 Dopamine D1 receptor 97.20% 91.00%
CHEMBL2581 P07339 Cathepsin D 96.73% 98.95%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 95.56% 95.56%
CHEMBL2535 P11166 Glucose transporter 92.56% 98.75%
CHEMBL1293249 Q13887 Kruppel-like factor 5 92.21% 86.33%
CHEMBL1951 P21397 Monoamine oxidase A 91.64% 91.49%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 89.25% 91.11%
CHEMBL5697 Q9GZT9 Egl nine homolog 1 89.10% 93.40%
CHEMBL5608 Q16288 NT-3 growth factor receptor 88.65% 95.89%
CHEMBL1907600 Q00535 Cyclin-dependent kinase 5/CDK5 activator 1 88.40% 93.03%
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 87.15% 85.14%
CHEMBL241 Q14432 Phosphodiesterase 3A 86.44% 92.94%
CHEMBL2146302 O94925 Glutaminase kidney isoform, mitochondrial 86.42% 100.00%
CHEMBL225 P28335 Serotonin 2c (5-HT2c) receptor 85.32% 89.62%
CHEMBL1907603 Q05586 Glutamate NMDA receptor; GRIN1/GRIN2B 83.12% 95.89%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 82.78% 94.00%
CHEMBL2041 P07949 Tyrosine-protein kinase receptor RET 80.10% 91.79%
CHEMBL1907 P15144 Aminopeptidase N 80.08% 93.31%

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.
Aconitum karakolicum

Cross-Links

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PubChem 14824626
LOTUS LTS0229614
wikiData Q104968829