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468-89-3 | (1R,9aα)-Octahydro-4β-(3-furyl)-1,7β-dimethyl-2H-quinolizine 5α-oxide
CAS No: 468-89-3 Catalog No: AG00DLO0 MDL No:
Product Description
Catalog Number:
AG00DLO0
Chemical Name:
(1R,9aα)-Octahydro-4β-(3-furyl)-1,7β-dimethyl-2H-quinolizine 5α-oxide
CAS Number:
468-89-3
IUPAC Name:
(1R,4S,5R,7S,9aS)-4-(furan-3-yl)-1,7-dimethyl-5-oxido-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-5-ium
InChI:
InChI=1S/C15H23NO2/c1-11-3-5-14-12(2)4-6-15(16(14,17)9-11)13-7-8-18-10-13/h7-8,10-12,14-15H,3-6,9H2,1-2H3/t11-,12+,14-,15-,16+/m0/s1
InChI Key:
HISDAJRMKAJROU-PTNZTPPNSA-N
UNII:
1XQ28IQ8WA
Properties
Complexity:
309
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
5
Defined Bond Stereocenter Count:
0
Exact Mass:
249.173g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.354g/mol
Monoisotopic Mass:
249.173g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
31.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Literature
| Title | Journal |
|---|---|
| Potent anti-metastatic activity of dimeric sesquiterpene thioalkaloids from the rhizome of Nuphar pumilum. | Bioorganic & medicinal chemistry letters 20031215 |
| Dimeric sesquiterpene thioalkaloids with potent immunosuppressive activity from the rhizome of Nuphar pumilum: structural requirements of nuphar alkaloids for immunosuppressive activity. | Bioorganic & medicinal chemistry 20010401 |
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