4,5-Dimethoxycanthin-6-one

For Research Use Only.
Category
Alkaloids
Cat.No.
NP0342
CAS
18110-87-7
Product Name
4,5-Dimethoxycanthin-6-one
Structure

Product Details

Description
4,5-Dimethoxycanthin-6-one isolated from the barks of Picrasma quassioides (D.Don) Benn.
Synonyms
Methyl nigakinone
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
Molecular Weight
280.3
Molecular Formula
C16H12N2O3
Canonical SMILES
COC1=C(C(=O)N2C3=CC=CC=C3C4=C2C1=NC=C4)OC
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
InChIKey
ATONBUGCNDSBBC-UHFFFAOYSA-N
Boiling Point
455.1±45.0°C (Predicted)
Melting Point
145-146°C
Purity
0.975
Density
1.4g/cm3
Appearance
Yellow powder
Application
antibacterial;
Form
Powder
pKa
3.51±0.20(Predicted)
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