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483-15-8 | 9,10-Dimethoxy-6,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolino[3,2-a]isoquinoline
CAS No: 483-15-8 Catalog No: AG006WY0 MDL No:MFCD00022312
Product Description
Catalog Number:
AG006WY0
Chemical Name:
9,10-Dimethoxy-6,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolino[3,2-a]isoquinoline
CAS Number:
483-15-8
Molecular Formula:
C20H19NO4
Molecular Weight:
337.3692
MDL Number:
MFCD00022312
IUPAC Name:
16,17-dimethoxy-5,7-dioxa-13-azapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(21),2,4(8),9,15(20),16,18-heptaene
InChI:
InChI=1S/C20H19NO4/c1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2/h3-4,7-9H,5-6,10-11H2,1-2H3
InChI Key:
FZAGOOYMTPGPGF-UHFFFAOYSA-N
SMILES:
COc1c(OC)ccc2c1CN1CCc3c(C1=C2)cc1c(c3)OCO1
NSC Number:
331264
Properties
Complexity:
538
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
337.131g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
337.375g/mol
Monoisotopic Mass:
337.131g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
Literature
| Title | Journal |
|---|---|
| Non-nucleoside reverse transcriptase inhibitor (NNRTI) cross-resistance: implications for preclinical evaluation of novel NNRTIs and clinical genotypic resistance testing. | The Journal of antimicrobial chemotherapy 20140101 |
| Structural optimization of berberine as a synergist to restore antifungal activity of fluconazole against drug-resistant Candida albicans. | ChemMedChem 20140101 |
| Structure-activity studies of some berberine analogs as inhibitors of Toxoplasma gondii. | Bioorganic & medicinal chemistry letters 20120415 |
| 8,8-Dimethyldihydroberberine with improved bioavailability and oral efficacy on obese and diabetic mouse models. | Bioorganic & medicinal chemistry 20100815 |
| QacR-cation recognition is mediated by a redundancy of residues capable of charge neutralization. | Biochemistry 20080805 |
| Berberine and its more biologically available derivative, dihydroberberine, inhibit mitochondrial respiratory complex I: a mechanism for the action of berberine to activate AMP-activated protein kinase and improve insulin action. | Diabetes 20080501 |
| Antiviral activity of berberine and related compounds against human cytomegalovirus. | Bioorganic & medicinal chemistry letters 20070315 |
| Synthesis of 13-(substituted benzyl) berberine and berberrubine derivatives as antifungal agents. | Bioorganic & medicinal chemistry letters 20060801 |
| [Simultaneous determination of three kinds of components in sanhuang tablets by high-performance liquid chromatography]. | Yao xue xue bao = Acta pharmaceutica Sinica 20060301 |
| Evaluation of natural products as inhibitors of human immunodeficiency virus type 1 (HIV-1) reverse transcriptase. | Journal of natural products 19910101 |
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