Dihydroisolysergic acid methyl ester
methyl (6aR,9S,10aR)-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carboxylate
Also Known As: Methyl dihydrolysergate|dihydroisolysergic acid methyl ester|Methyl 6-methylergoline-8alpha-carboxylate|6-Methylergoline-8alpha-carboxylic acid methyl ester|Ergoline-8-carboxylic acid, 6-methyl-, methyl ester, (8beta)-|Ergoline-8-carboxylic acid, 6-methyl-, methyl ester, (8I+/-)-|9,10-Dihydroisolysergic Acid I Methyl Ester; 6-Methylergoline-8-carboxylic Acid Methyl Ester;|methyl (2R,4S,7R)-6-methyl-6,11-diazatetracyclo[7.6.1.02,7.012,16]hexadeca-1(16),9,12,14-tetraene-4-carboxylate|methyl (6aR,9S,10aR)-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carboxylate
| Molecular Formula | C17H20N2O2 |
|---|---|
| Molecular Weight | 284.15247 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 45.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.15247 |
| Monoisotopic Mass | 284.15247 |
| Heavy Atoms | 21 |
| Complexity | 427.0 |
Chemical Identifiers
| CAS Number | 35470-53-2 |
|---|---|
| SMILES | CN1C[C@H](C[C@H]2[C@H]1CC3=CNC4=CC=CC2=C34)C(=O)OC |
| InChIKey | OSKZYLPFYNARRX-NJZAAPMLSA-N |
Product Overview
Dihydroisolysergic acid methyl ester (CAS 35470-53-2), with molecular formula C17H20N2O2 and molecular weight 284.15247 g/mol. IUPAC: methyl (6aR,9S,10aR)-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carboxylate.
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