Phlegmariurine B
6-methyl-9-azatricyclo[7.4.3.04,13]hexadec-1(13)-ene-2,8-dione
Also Known As: Phlegmariurine B|6-methyl-9-azatricyclo[7.4.3.04,13]hexadec-1(13)-ene-2,8-dione|6-methyl-9-azatricyclo(7.4.3.04,13)hexadec-1(13)-ene-2,8-dione|7-Methyl-2,3,7,8,8a,9-hexahydro-4,11-propanocyclopenta[e]azecine-5,10(1H,6H)-dione|4,11-Propano-4H-cyclopent(e)azecine-5,10(1H,6H)-dione, 2,3,7,8,8a,9-hexahydro-7-methyl-, (4S,7R,8aS)-
CAS: 93754-83-7
| Molecular Formula | C16H23NO2 |
|---|---|
| Molecular Weight | 261.17288 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 261.17288 |
| Monoisotopic Mass | 261.17288 |
| Heavy Atoms | 19 |
| Complexity | 438.0 |
Chemical Identifiers
| CAS Number | 93754-83-7 |
|---|---|
| SMILES | CC1CC2CC(=O)C3=C2CCCN(CCC3)C(=O)C1 |
| InChIKey | YPKNWWHNAWQDKM-UHFFFAOYSA-N |
Product Overview
Phlegmariurine B (CAS 93754-83-7), with molecular formula C16H23NO2 and molecular weight 261.17288 g/mol. IUPAC: 6-methyl-9-azatricyclo[7.4.3.04,13]hexadec-1(13)-ene-2,8-dione.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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