Navigation

name Structure Reference Source Properties Activities Metabolism

3-hydroxy-4-methoxy-1,6-diazatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-3,5,7,9(16),10(15),11,13-heptaen-2-one

AlkaPlorer ID: AK028554

Synonym: '4-Methoxy-5-hydroxycanthin-6-one', 'MLS000574953', 'SMR001215932'

IUPAC Name: 3-hydroxy-4-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=C(O)C(=O)N2C3=CC=CC=C3C3=CC=NC1=C32

copy

InChI: InChI=1S/C15H10N2O3/c1-20-14-11-12-9(6-7-16-11)8-4-2-3-5-10(8)17(12)15(19)13(14)18/h2-7,18H,1H3

copy

InChIKey: PGFKZUOYIFDMQJ-UHFFFAOYSA-N

copy

Reference

Neue Inhaltsstoffe aus Picrasma excelsa, I

PubChem CID: 5320161

CAS: 18110-86-6

LOTUS: LTS0073165

SuperNatural Ⅲ: SN0284596

COCONUT: CNP0206776

data_source: manually

Source

Species Genus Family Order Class Phylum Kingdom Domain
Quassia amara Quassia Simaroubaceae Sapindales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 266.25600000000003

TPSA？: 63.83

MolLogP？: 2.1529

Number of H-Donors: 1

Number of H-Acceptors: 5

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Homo sapiens CNE-2 IC50 7.96 ug.mL-1 10.1016/j.ejmech.2021.113688
Homo sapiens DNA polymerase iota Potency 4744.4 nM None
Homo sapiens DNA polymerase iota Potency 39810.7 nM None
Homo sapiens Flap endonuclease 1 Potency 11220.2 nM None
Homo sapiens Glutaminase kidney isoform, mitochondrial Potency 35481.3 nM None
Homo sapiens GTP-binding nuclear protein Ran/Importin subunit beta-1/Snurportin-1 Potency 31622.8 nM None
Homo sapiens Guanine nucleotide-binding protein G(s), subunit alpha Potency 35481.3 nM None
Homo sapiens HepG2 Potency 5623.4 nM None
Homo sapiens Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 Potency 3548.1 nM None
Homo sapiens Importin subunit beta-1/Snurportin-1 Potency 22387.2 nM None
Homo sapiens Lysine-specific demethylase 4A Potency 79432.8 nM None
Homo sapiens Mothers against decapentaplegic homolog 3 Potency 31622.8 nM None
Homo sapiens Protein-tyrosine phosphatase 1B Inhibition 42.8 % 10.1016/j.bmcl.2015.03.014
Homo sapiens TAR DNA-binding protein 43 Potency 1122.0 nM None
Homo sapiens Ubiquitin carboxyl-terminal hydrolase 1 Potency 39810.7 nM None
Meriones unguiculatus Meriones unguiculatus Activity 13.9 % 10.1016/j.bmcl.2016.09.006
Meriones unguiculatus Meriones unguiculatus Activity 40.0 % 10.1016/j.bmcl.2016.09.006
Plasmodium falciparum Plasmodium falciparum Potency 8275.3 nM None
Plasmodium falciparum Plasmodium falciparum Potency 10417.9 nM None
Schistosoma mansoni Thioredoxin glutathione reductase Potency 3981.1 nM None

Metabolism Information