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name Structure Reference Source Properties Activities Metabolism

8-chloro-6-hydroxy-9-nitro-3H,3aH,4H,5H,9bH-cyclopenta[c]quinoline-4-carboxylic acid

AlkaPlorer ID: AK557909

Synonym: None

IUPAC Name: 8-chloro-6-hydroxy-9-nitro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-4-carboxylic acid

Structure

SMILES: O=C(O)C1NC2=C(O)C=C(Cl)C([N+](=O)[O-])=C2C2C=CCC12

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InChI: InChI=1S/C13H11ClN2O5/c14-7-4-8(17)11-9(12(7)16(20)21)5-2-1-3-6(5)10(15-11)13(18)19/h1-2,4-6,10,15,17H,3H2,(H,18,19)

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InChIKey: WGUAPOVFDKLQGB-UHFFFAOYSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain

Properties Information

Molecule Weight: 310.69300000000004

TPSA？: 112.70000000000002

MolLogP？: 2.4922000000000004

Number of H-Donors: 3

Number of H-Acceptors: 5

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Bacillus subtilis 4'-phosphopantetheinyl transferase ffp Potency 56234.1 nM None
Caenorhabditis elegans Cytoplasmic zinc-finger protein EC50 215930.0 nM None
Caenorhabditis elegans Zinc finger protein mex-5 EC50 19148.0 nM None
Escherichia coli K-12 Beta-lactamase AmpC Potency 39810.7 nM None
Giardia intestinalis Putative fructose-1,6-bisphosphate aldolase Potency 15811.4 nM None
Homo sapiens Aldehyde dehydrogenase 1A1 Potency 12589.3 nM None
Homo sapiens Ataxin-2 Potency 112.2 nM None
Homo sapiens ATP-dependent DNA helicase Q1 Potency 1258.9 nM None
Homo sapiens ATP-dependent DNA helicase Q1 Potency 1778.3 nM None
Homo sapiens Bloom syndrome protein Potency 1778.3 nM None
Homo sapiens Bromodomain adjacent to zinc finger domain protein 2B Potency 1412.5 nM None
Homo sapiens Chromobox protein homolog 1 Potency 4466.8 nM None
Homo sapiens DNA-(apurinic or apyrimidinic site) lyase Potency 2511.9 nM None
Homo sapiens DNA polymerase beta Potency 251.2 nM None
Homo sapiens DNA polymerase eta Potency 1258.9 nM None
Homo sapiens DNA polymerase eta Potency 4775.5 nM None
Homo sapiens DNA polymerase iota Potency 794.3 nM None
Homo sapiens DNA polymerase iota Potency 15003.0 nM None
Homo sapiens DNA polymerase kappa Potency 1778.3 nM None
Homo sapiens Enteropeptidase Potency 8912.5 nM None
Homo sapiens Flap endonuclease 1 Potency 10000.0 nM None
Homo sapiens Flap endonuclease 1 Potency 23934.1 nM None
Homo sapiens Glutaminase kidney isoform, mitochondrial Potency 3162.3 nM None
Homo sapiens Glyceraldehyde-3-phosphate dehydrogenase liver IC50 37800.0 nM None
Homo sapiens Guanine nucleotide-binding protein G(s), subunit alpha Potency 28183.8 nM None
Homo sapiens Heat shock 70 kDa protein 1 IC50 22400.0 nM None
Homo sapiens Heat shock cognate 71 kDa protein IC50 175000.0 nM None
Homo sapiens Histone acetyltransferase GCN5 Potency 3162.3 nM None
Homo sapiens Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 Potency 2818.4 nM None
Homo sapiens Importin subunit beta-1/Snurportin-1 Potency 100000.0 nM None
Homo sapiens Induced myeloid leukemia cell differentiation protein Mcl-1 IC50 54000.0 nM None
Homo sapiens Keap1/Nrf2 AC50 52000.0 nM None
Homo sapiens Kelch-like ECH-associated protein 1 Max_Activity_Concent 26.0 uM None
Homo sapiens Lethal(3)malignant brain tumor-like protein 1 Potency 316.2 nM None
Homo sapiens Lysine-specific demethylase 4A Potency 11220.2 nM None
Homo sapiens Lysine-specific demethylase 4D-like Potency 7943.3 nM None
Homo sapiens Lysosomal alpha-glucosidase Potency 28183.8 nM None
Homo sapiens Menin/Histone-lysine N-methyltransferase MLL Potency 7943.3 nM None
Homo sapiens Menin/Histone-lysine N-methyltransferase MLL Potency 19952.6 nM None
Homo sapiens Microtubule-associated protein tau Potency 7079.5 nM None
Homo sapiens Microtubule-associated protein tau Potency 7943.3 nM None
Homo sapiens Microtubule-associated protein tau Potency 14125.4 nM None
Homo sapiens Muscleblind-like protein 1 Potency 19952.6 nM None
Homo sapiens Prelamin-A/C Potency 100.0 nM None
Homo sapiens Protein-tyrosine phosphatase LC-PTP IC50 3840.0 nM None
Homo sapiens Pyruvate kinase isozymes M1/M2 Potency 631.0 nM None
Homo sapiens Rac GTPase-activating protein 1 IC50 27870.0 nM None
Homo sapiens Rap guanine nucleotide exchange factor 3 Potency 12589.3 nM None
Homo sapiens Regulator of G-protein signaling 4 Potency 50118.7 nM None
Homo sapiens Serine/threonine-protein kinase PLK1 Potency 2993.5 nM None
Homo sapiens Thyroid hormone receptor beta-1 Potency 12589.3 nM None
Homo sapiens Thyroid hormone receptor beta-1 Potency 44668.4 nM None
Homo sapiens Troponin, cardiac muscle IC50 10997.0 nM None
Homo sapiens Tyrosyl-DNA phosphodiesterase 1 Potency 14988.9 nM None
Homo sapiens Ubiquitin carboxyl-terminal hydrolase 1 Potency 31622.8 nM None
Homo sapiens Ubiquitin carboxyl-terminal hydrolase 2 Potency 3981.1 nM None
Homo sapiens Ubiquitin carboxyl-terminal hydrolase 2 Potency 9268.3 nM None
Homo sapiens Ubiquitin carboxyl-terminal hydrolase 2 Potency 14125.4 nM None
Homo sapiens Werner syndrome ATP-dependent helicase Potency 5011.9 nM None
Human herpesvirus 8 ORF 73 AC50 5015.0 nM None
Human immunodeficiency virus type 1 group M subtype B (isolate HXB2)(HIV-1) Human immunodeficiency virus type 1 Tat protein IC50 1640.0 nM None
Leishmania mexicana Pyruvate kinase Potency 19952.6 nM None
Mus musculus Eukaryotic translation initiation factor 4E IC50 5210.0 nM None
Mus musculus Nuclear receptor ROR-gamma Potency 10000.0 nM None
Mycobacterium tuberculosis Protein RecA EC50 11500.0 nM None
Mycobacterium tuberculosis Replicative DNA helicase AC50 10890.0 nM None
Mycobacterium tuberculosis Replicative DNA helicase AC50 12760.0 nM None
Photinus pyralis Luciferin 4-monooxygenase Potency 13459.1 nM None
Plasmodium falciparum Plasmodium falciparum Potency 465.4 nM None
Plasmodium falciparum Plasmodium falciparum Potency 1041.8 nM None
Rattus norvegicus Dual specificity protein phosphatase 6 IC50 35393.0 nM None
Rattus norvegicus Dual specificity protein phosphatase 6 IC50 36800.0 nM None
Rattus norvegicus Thioredoxin reductase 1, cytoplasmic Potency 14125.4 nM None
Schistosoma japonicum Glutathione-S-transferase IC50 100000.0 nM None
Schistosoma mansoni Thioredoxin glutathione reductase Potency 3548.1 nM None
Simian virus 40 Large T antigen IC50 9860.0 nM None
Trypanosoma brucei 6-phospho-1-fructokinase Potency 37933.0 nM None
Trypanosoma brucei brucei Phosphoglycerate kinase, glycosomal Potency 4466.8 nM None
Trypanosoma brucei brucei (strain 927/4 GUTat10.1) Phosphoglycerate kinase Potency 1456.6 nM None
None Unchecked AC50 28100.0 nM None
None Unchecked AC50 31460.0 nM None
None Unchecked EC50 27670.0 nM None
None Unchecked EC50 110000.0 nM None
None Unchecked IC50 230.0 nM None
None Unchecked IC50 50000.0 nM None
None Unchecked Potency 4.6 nM None
None Unchecked Potency 2238.7 nM None
None Unchecked Potency 18356.4 nM None

Metabolism Information