Paspalic acid
(6aR,10aR)-7-methyl-6,6a,8,10a-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxylic acid
Also Known As: Paspalic acid, Ergoline-8-carboxylic acid, 8,9-didehydro-6-methyl-, .DELTA.8-LYSERGIC ACID, 6-Methyl-delta 8,9-ergoline-8-carboxylic acid, Methylergometrine Maleate Impurity 11, J3.278.213B, 6-METHYLERGOL-8-ENE-8-CARBOXYLIC ACID, 6-Methyl-8,9-didehydroergoline-8-carboxylic acid, 6-METHYL-ERGOL-8,9-ENE-8-CARBOXYLIC ACID, 8,9-Didehydro-6-methylergoline-8-carboxylic acid, Ergoline-8-carboxylic acid,8,9-didehydro-6-methyl-, (6aR,10aR)-7-methyl-6,6a,8,10a-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxylic acid, (6aR,10aR)-7-methyl-4,6,6a,7,8,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxylic acid, (2R,7R)-6-methyl-6,11-diazatetracyclo[7.6.1.02,7.012,16]hexadeca-1(16),3,9,12,14-pentaene-4-carboxylic acid, 611-233-8
| Molecular Formula | C16H16N2O2 |
|---|---|
| Molecular Weight | 268.1212 g/mol |
| LogP | 2.13 |
| Topological Polar Surface Area | 56.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 268.1212 |
| Heavy Atoms | 20 |
| Complexity | 744 |
Chemical Identifiers
| CAS Number | 5516-88-1 |
|---|---|
| SMILES | CN1CC(=C[C@H]2[C@H]1CC3=CNC4=CC=CC2=C34)C(=O)O |
Product Overview
Paspalic acid (CAS 5516-88-1), with molecular formula C16H16N2O2 and molecular weight 268.1212 g/mol. IUPAC: (6aR,10aR)-7-methyl-6,6a,8,10a-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxylic acid.
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