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4,5-Dimethoxycanthin-6-one

AlkaPlorer ID: AK033837

Synonym: ''

IUPAC Name: 3,4-dimethoxy-1,6-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-3,5(16),6,8,10,12,14-heptaen-2-one

Structure

SMILES: COC1=C(OC)C2=NC=CC3=C2N(C1=O)C1=CC=CC=C31

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InChI: InChI=1S/C16H12N2O3/c1-20-14-12-13-10(7-8-17-12)9-5-3-4-6-11(9)18(13)16(19)15(14)21-2/h3-8H,1-2H3

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InChIKey: ATONBUGCNDSBBC-UHFFFAOYSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Alangium chinense Alangium Cornaceae Cornales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 280.283

TPSA？: 52.830000000000005

MolLogP？: 2.4559000000000006

Number of H-Donors: 0

Number of H-Acceptors: 5

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Coxsackievirus Coxsackievirus IC50 7400.0 nM 10.1021/np4000747
Homo sapiens A2780 Activity nan None 10.1021/np4000747
Homo sapiens A549 Activity nan None 10.1021/np4000747
Homo sapiens Bel-7402 Activity nan None 10.1021/np4000747
Homo sapiens BGC-823 Activity nan None 10.1021/np4000747
Homo sapiens CNE-2 IC50 9.86 ug.mL-1 10.1016/j.ejmech.2021.113688
Homo sapiens HCT-8 Activity nan None 10.1021/np4000747
Homo sapiens Protein-tyrosine phosphatase 1B Inhibition 26.5 % 10.1016/j.bmcl.2015.03.014
Meriones unguiculatus Meriones unguiculatus Activity 20.8 % 10.1016/j.bmcl.2016.09.006
Meriones unguiculatus Meriones unguiculatus Activity 40.0 % 10.1016/j.bmcl.2016.09.006
Rattus norvegicus Liver microsomes IC50 nan None 10.1021/np4000747
Tobacco mosaic virus Tobacco mosaic virus EC50 130000.0 nM 10.1021/jf901632j
Tobacco mosaic virus Tobacco mosaic virus EC50 189000.0 nM 10.1021/jf901632j
Tobacco mosaic virus Tobacco mosaic virus Inhibition 33.3 % 10.1021/jf901632j
Tobacco mosaic virus Tobacco mosaic virus Inhibition 42.6 % 10.1021/jf901632j
Tobacco mosaic virus Tobacco mosaic virus Inhibition 43.8 % 10.1021/jf901632j
Tobacco mosaic virus Tobacco mosaic virus Inhibition 58.3 % 10.1021/jf901632j
Tobacco mosaic virus Tobacco mosaic virus Inhibition 59.0 % 10.1021/jf901632j
Tobacco mosaic virus Tobacco mosaic virus Inhibition 61.1 % 10.1021/jf901632j

Metabolism Information