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9-methoxycanthin-6-one

AlkaPlorer ID: AK011996

Synonym: '', '8-Methoxycanthin-6-one', '8-methoxycanthin-6-one', '13-methoxy-1,6-diazatetracyclo7.6.1.0(5,16).0(10,15)hexadeca-3,5(16),6,8,10,12,14-heptaen-2-one', '9-Methoxycanthin-6-one'

IUPAC Name: 13-methoxy-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=CC=C2C3=CC=NC4=C3N(C(=O)C=C4)C2=C1

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InChI: InChI=1S/C15H10N2O2/c1-19-9-2-3-10-11-6-7-16-12-4-5-14(18)17(15(11)12)13(10)8-9/h2-8H,1H3

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InChIKey: OWCRARVHWCCRAG-UHFFFAOYSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Eurycoma longifolia Eurycoma Simaroubaceae Sapindales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 250.257

TPSA？: 43.6

MolLogP？: 2.4473000000000003

Number of H-Donors: 0

Number of H-Acceptors: 4

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Chlorocebus sabaeus Vero CC50 100000.0 nM 10.1021/acs.jnatprod.2c00736
Homo sapiens A549 ED50 2.5 ug ml-1 10.1021/np030277n
Homo sapiens A549 Inhibition 55.0 % 10.1021/np030277n
Homo sapiens Breast carcinoma cell IC50 1.4 ug.mL-1 10.1016/j.ejmech.2021.113688
Homo sapiens Calu-3 CC50 100000.0 nM 10.1021/acs.jnatprod.2c00736
Homo sapiens Colon cancer cell line IC50 1.4 ug.mL-1 10.1016/j.ejmech.2021.113688
Homo sapiens HCT-8 Activity 33.49 % 10.1021/acs.jnatprod.2c00736
Homo sapiens HCT-8 CC50 21080.0 nM 10.1021/acs.jnatprod.2c00736
Homo sapiens HEK293 Activity nan None 10.1021/np400701k
Homo sapiens HepG2 CC50 100000.0 nM 10.1021/acs.jnatprod.2c00736
Homo sapiens KB ED5 2.1 ug ml-1 10.1021/np50077a020
Homo sapiens KB IC50 1.4 ug.mL-1 10.1016/j.ejmech.2021.113688
Homo sapiens Lung cancer cell line IC50 1.4 ug.mL-1 10.1016/j.ejmech.2021.113688
Homo sapiens MCF7 ED50 4.5 ug ml-1 10.1021/np030277n
Homo sapiens Melanoma cell line IC50 1.4 ug.mL-1 10.1016/j.ejmech.2021.113688
Homo sapiens MRC5 CC50 100000.0 nM 10.1021/acs.jnatprod.2c00736
Homo sapiens Protein-tyrosine phosphatase 1B Inhibition 34.9 % 10.1016/j.bmcl.2015.03.014
Mus musculus P388 ED50 1.4 ug ml-1 10.1021/np50077a020
None Fibrosarcoma cell line IC50 1.4 ug.mL-1 10.1016/j.ejmech.2021.113688
None NON-PROTEIN TARGET ED5 2.5 ug ml-1 10.1021/np50077a020
None NON-PROTEIN TARGET ED5 3.5 ug ml-1 10.1021/np50077a020
None NON-PROTEIN TARGET ED5 4.0 ug ml-1 10.1021/np50077a020
None NON-PROTEIN TARGET ED5 4.2 ug ml-1 10.1021/np50077a020
None NON-PROTEIN TARGET ED5 4.5 ug ml-1 10.1021/np50077a020
None NON-PROTEIN TARGET ED5 20.0 ug ml-1 10.1021/np50077a020
None Unchecked Activity 20.0 % 10.1021/acs.jnatprod.2c00736
None Unchecked IC50 1.4 ug.mL-1 10.1016/j.ejmech.2021.113688
None Unchecked IC50 7400.0 nM 10.1021/np400701k
None Unchecked Inhibition 50.0 % 10.1021/np400701k

Metabolism Information