Isolysergol
[(6aR,9S)-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinolin-9-yl]methanol
Also Known As: Isolysergol|lysergol|(+)-Isolysergol|J2.590.289K|9,10-Didehydro-6-methylergoline-8alpha-methanol|Ergoline-8-methanol, 9,10-didehydro-6-methyl-, (8alpha)-|(6-Methyl-9,10-didehydroergolin-8alpha-yl)methanol|(8alpha)-9,10-Didehydro-6-methylergoline-8-methanol|(5beta)-9,10-Didehydro-6-methylergoline-8alpha-methanol|((6aR,9S)-7-methyl-6,6a,8,9-tetrahydro-4H-indolo(4,3-fg)quinolin-9-yl)methanol|[(4S,7R)-6-methyl-6,11-diazatetracyclo[7.6.1.02,7.012,16]hexadeca-1(16),2,9,12,14-pentaen-4-yl]methanol
| Molecular Formula | C16H18N2O |
|---|---|
| Molecular Weight | 254.1419 g/mol |
| LogP | 2.0299 |
| Topological Polar Surface Area | 39.26 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 254.1419 |
| Monoisotopic Mass | 254.1419 |
| Heavy Atoms | 19 |
| Complexity | 670.4388 |
Chemical Identifiers
| CAS Number | 478-93-3 |
|---|---|
| SMILES | CN1C[C@H](C=C2[C@H]1CC3=CNC4=CC=CC2=C34)CO |
Product Overview
Isolysergol (CAS 478-93-3), with molecular formula C16H18N2O and molecular weight 254.1419 g/mol. IUPAC: [(6aR,9S)-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinolin-9-yl]methanol.