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50656-80-9 | [13S,13aR,(+)]-5,8,13,13a-Tetrahydro-2,9-dimethoxy-13-methyl-6H-dibenzo[a,g]quinolizine-3,10-diol
CAS No: 50656-80-9 Catalog No: AG00E1K7 MDL No:
Product Description
Catalog Number:
AG00E1K7
Chemical Name:
[13S,13aR,(+)]-5,8,13,13a-Tetrahydro-2,9-dimethoxy-13-methyl-6H-dibenzo[a,g]quinolizine-3,10-diol
CAS Number:
50656-80-9
IUPAC Name:
(13S,13aR)-2,9-dimethoxy-13-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline-3,10-diol
InChI:
InChI=1S/C20H23NO4/c1-11-13-4-5-16(22)20(25-3)15(13)10-21-7-6-12-8-17(23)18(24-2)9-14(12)19(11)21/h4-5,8-9,11,19,22-23H,6-7,10H2,1-3H3/t11-,19+/m0/s1
InChI Key:
GWIIAEUJSONJQC-JEOXALJRSA-N
Properties
Complexity:
475
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
341.163g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
341.407g/mol
Monoisotopic Mass:
341.163g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
62.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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