8-Methoxy-2-(8-methoxy-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-7-yl)-6-methylnaphthalen-1-ol

Details

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Internal ID f3adce7a-2097-4c32-b858-eb372f7832bb
Taxonomy Organoheterocyclic compounds > Isoquinolines and derivatives > Naphthylisoquinolines
IUPAC Name 8-methoxy-2-(8-methoxy-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-7-yl)-6-methylnaphthalen-1-ol
SMILES (Canonical) CC1CC2=C(C(N1)C)C(=C(C=C2)C3=C(C4=C(C=C3)C=C(C=C4OC)C)O)OC
SMILES (Isomeric) CC1CC2=C(C(N1)C)C(=C(C=C2)C3=C(C4=C(C=C3)C=C(C=C4OC)C)O)OC
InChI InChI=1S/C24H27NO3/c1-13-10-16-6-8-18(23(26)22(16)20(11-13)27-4)19-9-7-17-12-14(2)25-15(3)21(17)24(19)28-5/h6-11,14-15,25-26H,12H2,1-5H3
InChI Key ZYBIVXYBCOCORX-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C24H27NO3
Molecular Weight 377.50 g/mol
Exact Mass 377.19909372 g/mol
Topological Polar Surface Area (TPSA) 50.70 Ų
XlogP 5.00

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 8-Methoxy-2-(8-methoxy-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-7-yl)-6-methylnaphthalen-1-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
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 98.09% 91.11%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 97.73% 96.09%
CHEMBL1951 P21397 Monoamine oxidase A 95.14% 91.49%
CHEMBL4793 Q86TI2 Dipeptidyl peptidase IX 93.76% 96.95%
CHEMBL2581 P07339 Cathepsin D 93.06% 98.95%
CHEMBL241 Q14432 Phosphodiesterase 3A 92.10% 92.94%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 91.87% 94.00%
CHEMBL4208 P20618 Proteasome component C5 90.06% 90.00%
CHEMBL3060 Q9Y345 Glycine transporter 2 89.20% 99.17%
CHEMBL2041 P07949 Tyrosine-protein kinase receptor RET 88.58% 91.79%
CHEMBL213 P08588 Beta-1 adrenergic receptor 88.35% 95.56%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 88.25% 95.56%
CHEMBL225 P28335 Serotonin 2c (5-HT2c) receptor 87.73% 89.62%
CHEMBL1293249 Q13887 Kruppel-like factor 5 86.42% 86.33%
CHEMBL3137262 O60341 LSD1/CoREST complex 86.28% 97.09%
CHEMBL4657 Q6V1X1 Dipeptidyl peptidase VIII 84.99% 97.21%
CHEMBL5747 Q92793 CREB-binding protein 84.14% 95.12%
CHEMBL2535 P11166 Glucose transporter 82.22% 98.75%
CHEMBL4581 P52732 Kinesin-like protein 1 81.67% 93.18%
CHEMBL2095226 P05556 Integrin alpha-5/beta-1 81.45% 96.39%
CHEMBL2378 P30307 Dual specificity phosphatase Cdc25C 80.77% 96.67%
CHEMBL5608 Q16288 NT-3 growth factor receptor 80.65% 95.89%

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.
Taxus brevifolia
Triphyophyllum peltatum

Cross-Links

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PubChem 85189748
LOTUS LTS0151157
wikiData Q105373128