Fumigaclavine A
[(6aR,9R,10S)-7,9-dimethyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinolin-10-yl] acetate
Also Known As: Fumigaclavine A|Isofumigaclavine A|HB3902|Ergolin-9-ol, 6,8-dimethyl-, acetate (ester), (8-alpha,9-beta)-
CAS: 6879-59-0
| Molecular Formula | C18H22N2O2 |
|---|---|
| Molecular Weight | 298.16812 g/mol |
| LogP | 2.6894 |
| Topological Polar Surface Area | 45.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 298.16812 |
| Monoisotopic Mass | 298.16812 |
| Heavy Atoms | 22 |
| Complexity | 735.76245 |
Chemical Identifiers
| CAS Number | 6879-59-0 |
|---|---|
| SMILES | C[C@@H]1CN([C@@H]2CC3=CNC4=CC=CC(=C34)C2[C@H]1OC(=O)C)C |
Product Overview
Fumigaclavine A (CAS 6879-59-0), with molecular formula C18H22N2O2 and molecular weight 298.16812 g/mol. IUPAC: [(6aR,9R,10S)-7,9-dimethyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinolin-10-yl] acetate.
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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