Senecionine N-oxide
(1R,6R,7R,17R)-4-ethylidene-7-hydroxy-6,7-dimethyl-14-oxido-2,9-dioxa-14-azoniatricyclo[9.5.1.014,17]heptadec-11-ene-3,8-dione
Also Known As: Senecionine N-oxide|NCI60_000157
| Molecular Formula | C18H25NO6 |
|---|---|
| Molecular Weight | 351.16818 g/mol |
| LogP | 1.21 |
| Topological Polar Surface Area | 95.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 351.16818 |
| Heavy Atoms | 25 |
| Complexity | 652.0 |
Chemical Identifiers
| CAS Number | 13268-67-2 |
|---|---|
| SMILES | CC=C1C[C@H]([C@@](C(=O)OCC2=CC[N+]3([C@H]2[C@@H](CC3)OC1=O)[O-])(C)O)C |
Product Overview
Senecionine N-oxide (CAS 13268-67-2), with molecular formula C18H25NO6 and molecular weight 351.16818 g/mol. IUPAC: (1R,6R,7R,17R)-4-ethylidene-7-hydroxy-6,7-dimethyl-14-oxido-2,9-dioxa-14-azoniatricyclo[9.5.1.014,17]heptadec-11-ene-3,8-dione.
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