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60426-50-8 | (4R)-4α-Ethyl-1,3,4,4aβ,5,7,12,12aβ-octahydro-2-methylpyrido[3',4'
CAS No: 60426-50-8 Catalog No: AG00F4AB MDL No:
Product Description
Catalog Number:
AG00F4AB
Chemical Name:
(4R)-4α-Ethyl-1,3,4,4aβ,5,7,12,12aβ-octahydro-2-methylpyrido[3',4'
CAS Number:
60426-50-8
IUPAC Name:
(3S,7R,8S)-7-ethyl-5-methyl-5,12-diazatetracyclo[9.7.0.03,8.013,18]octadeca-1(11),13,15,17-tetraen-10-one
InChI:
InChI=1S/C19H24N2O/c1-3-12-10-21(2)11-13-8-16-14-6-4-5-7-17(14)20-19(16)18(22)9-15(12)13/h4-7,12-13,15,20H,3,8-11H2,1-2H3/t12-,13+,15-/m0/s1
InChI Key:
DPBYCORQBMMFJZ-GUTXKFCHSA-N
Properties
Complexity:
437
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
296.189g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
296.414g/mol
Monoisotopic Mass:
296.189g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
36.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
Literature
| Title | Journal |
|---|---|
| A synthetic approach to ervatamine-silicine alkaloids. Enantioselective total synthesis of (-)-16-episilicine. | The Journal of organic chemistry 20100101 |
| Enantioselective total synthesis of the indole alkaloid 16-episilicine. | Chemical communications (Cambridge, England) 20090528 |
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