Mukolidine

Details

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Internal ID 45e94ef7-be36-4c7d-a87c-4bd5933b9e32
Taxonomy Organoheterocyclic compounds > Indoles and derivatives > Carbazoles
IUPAC Name 8-methoxy-9H-carbazole-3-carbaldehyde
SMILES (Canonical) COC1=CC=CC2=C1NC3=C2C=C(C=C3)C=O
SMILES (Isomeric) COC1=CC=CC2=C1NC3=C2C=C(C=C3)C=O
InChI InChI=1S/C14H11NO2/c1-17-13-4-2-3-10-11-7-9(8-16)5-6-12(11)15-14(10)13/h2-8,15H,1H3
InChI Key KSTPFEFAPRYLOZ-UHFFFAOYSA-N
Popularity 1 reference in papers

Physical and Chemical Properties

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Molecular Formula C14H11NO2
Molecular Weight 225.24 g/mol
Exact Mass 225.078978594 g/mol
Topological Polar Surface Area (TPSA) 42.10 Ų
XlogP 2.80

Synonyms

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3-formyl-8-methoxycarbazole
8-methoxy-9H-carbazole-3-carbaldehyde
6-Formyl-1-methoxycarbazole
CHEBI:178583
KSTPFEFAPRYLOZ-UHFFFAOYSA-N
DTXSID001280691
8-Methoxy-9H-carbazole-3-carboxaldehyde
87264-45-7
8-Methoxy-9H-carbazole-3-carboxaldehyde, 9CI

2D Structure

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2D Structure of Mukolidine

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
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 98.60% 95.56%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 93.92% 91.11%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 93.78% 96.09%
CHEMBL2288 Q13526 Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 91.82% 91.71%
CHEMBL2535 P11166 Glucose transporter 90.95% 98.75%
CHEMBL1255126 O15151 Protein Mdm4 90.79% 90.20%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 90.68% 96.00%
CHEMBL1293249 Q13887 Kruppel-like factor 5 88.65% 86.33%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 88.39% 94.45%
CHEMBL1163101 O75460 Serine/threonine-protein kinase/endoribonuclease IRE1 87.54% 98.11%
CHEMBL2581 P07339 Cathepsin D 86.70% 98.95%
CHEMBL1951 P21397 Monoamine oxidase A 86.23% 91.49%
CHEMBL1907 P15144 Aminopeptidase N 85.96% 93.31%
CHEMBL1806 P11388 DNA topoisomerase II alpha 81.28% 89.00%
CHEMBL1937 Q92769 Histone deacetylase 2 81.05% 94.75%
CHEMBL3091268 Q92753 Nuclear receptor ROR-beta 80.51% 95.50%

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.
Murraya koenigii
Wyethia helenioides

Cross-Links

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PubChem 53465568
LOTUS LTS0137993
wikiData Q105189199