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55974-08-8 | Oxoglaucine methiodide
CAS No: 55974-08-8 Catalog No: AG00E6C8 MDL No:
Product Description
Catalog Number:
AG00E6C8
Chemical Name:
Oxoglaucine methiodide
CAS Number:
55974-08-8
IUPAC Name:
4,5,15,16-tetramethoxy-10-methyl-10-azoniatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2,4,6,9,11,13,15-octaen-8-one;iodide
InChI:
InChI=1S/C21H20NO5.HI/c1-22-7-6-11-8-16(26-4)21(27-5)18-12-9-14(24-2)15(25-3)10-13(12)20(23)19(22)17(11)18;/h6-10H,1-5H3;1H/q+1;/p-1
InChI Key:
XIPYSOZMFQYKMU-UHFFFAOYSA-M
Properties
Complexity:
557
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
493.039g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
493.297g/mol
Monoisotopic Mass:
493.039g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
57.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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