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1862-41-5 | 5H-Benzo[g]-1,3-benzodioxolo[6,5,4-de]quinoline,6,7,7a,8-tetrahydro-, (7aR)-
CAS No: 1862-41-5 Catalog No: AG007SFI MDL No:
Product Description
Catalog Number:
AG007SFI
Chemical Name:
5H-Benzo[g]-1,3-benzodioxolo[6,5,4-de]quinoline,6,7,7a,8-tetrahydro-, (7aR)-
CAS Number:
1862-41-5
Molecular Formula:
C17H15NO2
Molecular Weight:
265.3065
IUPAC Name:
(12R)-3,5-dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1(20),2(6),7,14,16,18-hexaene
InChI:
InChI=1S/C17H15NO2/c1-2-4-12-10(3-1)7-13-15-11(5-6-18-13)8-14-17(16(12)15)20-9-19-14/h1-4,8,13,18H,5-7,9H2/t13-/m1/s1
InChI Key:
VZTUKBKUWSHDFM-CYBMUJFWSA-N
SMILES:
c1ccc2c(c1)C[C@@H]1c3c2c2OCOc2cc3CCN1
Properties
Complexity:
387
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
265.11g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
265.312g/mol
Monoisotopic Mass:
265.11g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
30.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
Literature
| Title | Journal |
|---|---|
| (-)-Anonaine induces apoptosis through Bax- and caspase-dependent pathways in human cervical cancer (HeLa) cells. | Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association 20080801 |
| Antioxidant and cytotoxic activities of canadine: biological effects and structural aspects. | Bioorganic & medicinal chemistry 20080401 |
| Effects of anonaine on dopamine biosynthesis and L-DOPA-induced cytotoxicity in PC12 cells. | Molecules (Basel, Switzerland) 20080227 |
| Advances in development of dopaminergic aporphinoids. | Journal of medicinal chemistry 20070125 |
| Vascular activity of (-)-anonaine, (-)-roemerine and (-)-pukateine, three natural 6a(R)-1,2-methylenedioxyaporphines with different affinities for alpha1-adrenoceptor subtypes. | Planta medica 20040701 |
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