14-Methoxy-8-oxa-17-azatetracyclo[8.7.0.02,7.011,15]heptadeca-1(17),2(7),3,5,10,15-hexaen-4-ol

Details

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Internal ID e54a55c9-1075-477d-b973-1da7d5ba15c0
Taxonomy Organoheterocyclic compounds > Benzopyrans > 1-benzopyrans
IUPAC Name 14-methoxy-8-oxa-17-azatetracyclo[8.7.0.02,7.011,15]heptadeca-1(17),2(7),3,5,10,15-hexaen-4-ol
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C16H15NO3/c1-19-14-5-3-10-12(14)7-17-16-11-6-9(18)2-4-15(11)20-8-13(10)16/h2,4,6-7,14,18H,3,5,8H2,1H3
InChI Key GGXULTHGGJJDGL-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C16H15NO3
Molecular Weight 269.29 g/mol
Exact Mass 269.10519334 g/mol
Topological Polar Surface Area (TPSA) 51.60 Ų
XlogP 1.80

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 14-Methoxy-8-oxa-17-azatetracyclo[8.7.0.02,7.011,15]heptadeca-1(17),2(7),3,5,10,15-hexaen-4-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
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 96.03% 85.14%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 94.66% 91.11%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 94.46% 96.09%
CHEMBL2243 O00519 Anandamide amidohydrolase 94.12% 97.53%
CHEMBL1907603 Q05586 Glutamate NMDA receptor; GRIN1/GRIN2B 92.14% 95.89%
CHEMBL5339 Q5NUL3 G-protein coupled receptor 120 91.74% 95.78%
CHEMBL1966 Q02127 Dihydroorotate dehydrogenase 91.64% 96.09%
CHEMBL5311 P37023 Serine/threonine-protein kinase receptor R3 91.20% 82.67%
CHEMBL1293249 Q13887 Kruppel-like factor 5 91.02% 86.33%
CHEMBL3060 Q9Y345 Glycine transporter 2 90.96% 99.17%
CHEMBL5697 Q9GZT9 Egl nine homolog 1 90.16% 93.40%
CHEMBL5608 Q16288 NT-3 growth factor receptor 89.74% 95.89%
CHEMBL2581 P07339 Cathepsin D 89.18% 98.95%
CHEMBL1994 P08235 Mineralocorticoid receptor 88.22% 100.00%
CHEMBL2107 P61073 C-X-C chemokine receptor type 4 88.06% 93.10%
CHEMBL2535 P11166 Glucose transporter 86.17% 98.75%
CHEMBL3137262 O60341 LSD1/CoREST complex 85.82% 97.09%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 85.10% 94.00%
CHEMBL1806 P11388 DNA topoisomerase II alpha 83.77% 89.00%
CHEMBL2292 Q13627 Dual-specificity tyrosine-phosphorylation regulated kinase 1A 83.25% 93.24%
CHEMBL4208 P20618 Proteasome component C5 82.40% 90.00%
CHEMBL2563 Q9UQL6 Histone deacetylase 5 82.00% 89.67%
CHEMBL241 Q14432 Phosphodiesterase 3A 81.75% 92.94%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 81.47% 99.23%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 81.31% 94.45%
CHEMBL2335 P42785 Lysosomal Pro-X carboxypeptidase 81.20% 100.00%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
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There are no matching plants.

Cross-Links

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PubChem 163021806
LOTUS LTS0088398
wikiData Q104167156