Precoccinelline
(1R,5S)-3-methyl-13-azatricyclo[7.3.1.05,13]tridecane
Also Known As: Precoccinelline|Alkaloid 193C|(1R,3r,5S,9r)-3-methyl-13-azatricyclo[7.3.1.05,13]tridecane|(1R,3r,5S,9s)-3-methyl-13-azatricyclo[7.3.1.05,13]tridecane|(3a?,6a?,9a?)-dodecahydro-2a-methylpyrido[2,1,6-de]quinolizine|rel-(2r,3aR,6as,9aS)-2-Methyldodecahydropyrido[2,1,6-de]quinolizine|(2alpha,3abeta,6abeta,9abeta)-Dodecahydro-2-methylpyrido[2,1,6-de]quinolizine|(2alpha,3abeta,6abeta,9abeta)-Dodecahydro-2alpha-methylpyrido[2,1,6-de]quinolizine|(2beta,3aalpha,6aalpha,9aalpha)-Dodecahydro-2-methylpyrido[2,1,6-de]quinolizine|(3aalpha,6abeta,9aalpha)-Dodecahydro-2beta-methylpyrido[2,1,6-de]quinolizine|(3abeta,6aalpha,9abeta)-Dodecahydro-2alpha-methylpyrido[2,1,6-de]quinolizine|(3abeta,6abeta,9abeta)-Dodecahydro-2alpha-methylpyrido[2,1,6-de]quinolizine|Pyrido(2,1,6-de)quinolizine, dodecahydro-2-methyl-, (2alpha,3abeta,6aalpha,9abeta)-
| Molecular Formula | C13H23N |
|---|---|
| Molecular Weight | 193.18304 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 193.18304 |
| Monoisotopic Mass | 193.18304 |
| Heavy Atoms | 14 |
| Complexity | 193.0 |
Chemical Identifiers
| CAS Number | 38211-56-2 |
|---|---|
| SMILES | CC1C[C@H]2CCCC3N2[C@H](C1)CCC3 |
| InChIKey | MOQNYBQLQBMEKL-BPNZPQAUSA-N |
Product Overview
Precoccinelline (CAS 38211-56-2), with molecular formula C13H23N and molecular weight 193.18304 g/mol. IUPAC: (1R,5S)-3-methyl-13-azatricyclo[7.3.1.05,13]tridecane.
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