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75491-93-9 | Dibenzo[a,g]quinolizinium,5,6-dihydro-3-hydroxy-2,10,11-trimethoxy-, chloride (9CI)
CAS No: 75491-93-9 Catalog No: AG005KOJ MDL No:
Product Description
Catalog Number:
AG005KOJ
Chemical Name:
Dibenzo[a,g]quinolizinium,5,6-dihydro-3-hydroxy-2,10,11-trimethoxy-, chloride (9CI)
CAS Number:
75491-93-9
Molecular Formula:
C20H20ClNO4
Molecular Weight:
373.8301
IUPAC Name:
2,10,11-trimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium-3-ol;chloride
InChI:
InChI=1S/C20H19NO4.ClH/c1-23-18-10-15-12(7-17(18)22)4-5-21-11-14-9-20(25-3)19(24-2)8-13(14)6-16(15)21;/h6-11H,4-5H2,1-3H3;1H
InChI Key:
CEGFSKDAZKTAPO-UHFFFAOYSA-N
SMILES:
COc1cc2cc3[n+](cc2cc1OC)CCc1c3cc(OC)c(c1)O.[Cl-]
Properties
Complexity:
461
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
373.108g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
373.833g/mol
Monoisotopic Mass:
373.108g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| Synthesis and biological evaluation of berberine analogues as novel up-regulators for both low-density-lipoprotein receptor and insulin receptor. | Bioorganic & medicinal chemistry letters 20091101 |
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