Akazamicin

Details

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Internal ID 44366ab6-5654-4770-865e-a0efff1102e1
Taxonomy Benzenoids > Naphthacenes > Tetracenequinones
IUPAC Name 3-(aminomethyl)-1,9,11,14-tetrahydroxy-7-methoxy-10-methyl-8,13-dioxo-5,6-dihydrobenzo[a]tetracene-2-carboxylic acid
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C26H21NO9/c1-8-13(28)6-12-17(20(8)29)24(33)19-18(21(12)30)23(32)16-11(25(19)36-2)4-3-9-5-10(7-27)15(26(34)35)22(31)14(9)16/h5-6,28-29,31-32H,3-4,7,27H2,1-2H3,(H,34,35)
InChI Key OBYRGISJWBDERZ-UHFFFAOYSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C26H21NO9
Molecular Weight 491.40 g/mol
Exact Mass 491.12163125 g/mol
Topological Polar Surface Area (TPSA) 188.00 Ų
XlogP 1.50

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of Akazamicin

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 99.23% 91.11%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 96.23% 95.56%
CHEMBL2581 P07339 Cathepsin D 95.01% 98.95%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 93.07% 96.09%
CHEMBL215 P09917 Arachidonate 5-lipoxygenase 92.67% 92.68%
CHEMBL4581 P52732 Kinesin-like protein 1 90.06% 93.18%
CHEMBL1293249 Q13887 Kruppel-like factor 5 89.85% 86.33%
CHEMBL3060 Q9Y345 Glycine transporter 2 88.53% 99.17%
CHEMBL4793 Q86TI2 Dipeptidyl peptidase IX 85.54% 96.95%
CHEMBL2535 P11166 Glucose transporter 84.46% 98.75%
CHEMBL2288 Q13526 Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 84.41% 91.71%
CHEMBL5845 P23415 Glycine receptor subunit alpha-1 83.18% 90.71%
CHEMBL4208 P20618 Proteasome component C5 83.11% 90.00%
CHEMBL3192 Q9BY41 Histone deacetylase 8 82.97% 93.99%
CHEMBL3492 P49721 Proteasome Macropain subunit 82.78% 90.24%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 82.29% 94.00%
CHEMBL3864 Q06124 Protein-tyrosine phosphatase 2C 81.29% 94.42%
CHEMBL3880 P07900 Heat shock protein HSP 90-alpha 81.06% 96.21%
CHEMBL1806 P11388 DNA topoisomerase II alpha 80.87% 89.00%
CHEMBL2007 P16234 Platelet-derived growth factor receptor alpha 80.49% 91.07%
CHEMBL5608 Q16288 NT-3 growth factor receptor 80.48% 95.89%

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 145720687
LOTUS LTS0103563
wikiData Q104193220