Carbazomycin E

Details

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Internal ID 3462edb3-ea0c-4c98-838d-0140d39ad04d
Taxonomy Organoheterocyclic compounds > Indoles and derivatives > Carbazoles
IUPAC Name 4-hydroxy-3-methoxy-2-methyl-9H-carbazole-1-carbaldehyde
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C15H13NO3/c1-8-10(7-17)13-12(14(18)15(8)19-2)9-5-3-4-6-11(9)16-13/h3-7,16,18H,1-2H3
InChI Key BEJNHSBULWLOJS-UHFFFAOYSA-N
Popularity 4 references in papers

Physical and Chemical Properties

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Molecular Formula C15H13NO3
Molecular Weight 255.27 g/mol
Exact Mass 255.08954328 g/mol
Topological Polar Surface Area (TPSA) 62.30 Ų
XlogP 2.80

Synonyms

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Carbazomycinal
103744-20-3
4-hydroxy-3-methoxy-2-methyl-9H-carbazole-1-carbaldehyde
DTXSID60146039
RefChem:123503
DTXCID9068530
9H-Carbazole-1-carboxaldehyde, 4-hydroxy-3-methoxy-2-methyl-
SCHEMBL16432825
SCHEMBL29787116

2D Structure

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2D Structure of Carbazomycin E

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 98.77% 95.56%
CHEMBL1163101 O75460 Serine/threonine-protein kinase/endoribonuclease IRE1 96.62% 98.11%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 94.55% 91.11%
CHEMBL2581 P07339 Cathepsin D 90.14% 98.95%
CHEMBL2288 Q13526 Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 89.96% 91.71%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 88.88% 94.45%
CHEMBL1821 P08173 Muscarinic acetylcholine receptor M4 88.45% 94.08%
CHEMBL2002 P12268 Inosine-5'-monophosphate dehydrogenase 2 87.50% 98.21%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 86.43% 99.23%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 85.72% 94.00%
CHEMBL1806 P11388 DNA topoisomerase II alpha 85.60% 89.00%
CHEMBL1951 P21397 Monoamine oxidase A 85.20% 91.49%
CHEMBL3401 O75469 Pregnane X receptor 84.82% 94.73%
CHEMBL1937 Q92769 Histone deacetylase 2 84.16% 94.75%
CHEMBL3192 Q9BY41 Histone deacetylase 8 83.29% 93.99%
CHEMBL2535 P11166 Glucose transporter 81.40% 98.75%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 81.14% 96.09%

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 128437
LOTUS LTS0209267
wikiData Q83010759