(1S)-10-methoxy-1-(2-methylprop-1-enyl)-1,9-dihydrofuro[3,4-b]carbazol-3-one

Details

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Internal ID 309db9fb-e1d6-4fdf-88b2-9d14ffb1dcc6
Taxonomy Organoheterocyclic compounds > Indoles and derivatives > Carbazoles
IUPAC Name (1S)-10-methoxy-1-(2-methylprop-1-enyl)-1,9-dihydrofuro[3,4-b]carbazol-3-one
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C19H17NO3/c1-10(2)8-15-16-13(19(21)23-15)9-12-11-6-4-5-7-14(11)20-17(12)18(16)22-3/h4-9,15,20H,1-3H3/t15-/m0/s1
InChI Key XZHTYICWMYOJBZ-HNNXBMFYSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C19H17NO3
Molecular Weight 307.30 g/mol
Exact Mass 307.12084340 g/mol
Topological Polar Surface Area (TPSA) 51.30 Ų
XlogP 4.50

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of (1S)-10-methoxy-1-(2-methylprop-1-enyl)-1,9-dihydrofuro[3,4-b]carbazol-3-one

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 98.42% 91.11%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 95.25% 95.56%
CHEMBL1806 P11388 DNA topoisomerase II alpha 93.74% 89.00%
CHEMBL1951 P21397 Monoamine oxidase A 93.34% 91.49%
CHEMBL2581 P07339 Cathepsin D 92.93% 98.95%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 92.77% 96.09%
CHEMBL1907600 Q00535 Cyclin-dependent kinase 5/CDK5 activator 1 87.40% 93.03%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 87.24% 99.23%
CHEMBL1293249 Q13887 Kruppel-like factor 5 85.38% 86.33%
CHEMBL2535 P11166 Glucose transporter 84.85% 98.75%
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 84.79% 85.14%
CHEMBL2373 P21730 C5a anaphylatoxin chemotactic receptor 84.11% 92.62%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 83.92% 94.00%
CHEMBL1937 Q92769 Histone deacetylase 2 82.55% 94.75%
CHEMBL213 P08588 Beta-1 adrenergic receptor 81.96% 95.56%
CHEMBL3060 Q9Y345 Glycine transporter 2 81.92% 99.17%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 81.82% 94.45%
CHEMBL3401 O75469 Pregnane X receptor 80.98% 94.73%
CHEMBL2708 Q16584 Mitogen-activated protein kinase kinase kinase 11 80.85% 81.14%
CHEMBL4040 P28482 MAP kinase ERK2 80.28% 83.82%

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.
Clausena lansium

Cross-Links

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PubChem 163049993
LOTUS LTS0057855
wikiData Q105344948